Organoheterocyclic compounds
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1-(2,3-Dichlorophenyl)piperazine monohydrochloride, 98+%, Thermo Scientific™
CAS: 119532-26-2 Molecular Formula: C10H13Cl3N2 Molecular Weight (g/mol): 267.578 MDL Number: MFCD00190238 InChI Key: CYQFNNSFAGXCEC-UHFFFAOYSA-N Synonym: 1-2,3-dichlorophenyl piperazine hydrochloride,1-2,3-dichlorophenyl piperazine monohydrochloride,1-2,3-dichlorophenyl-piperazine hydrochloride,2,3-dichlorophenylpiperazine hydrochloride,1-2,3-dichlorophenyl-piperazine monohydrochloride,1-2,3-dichlorophenyl piperazinehydrochloride,piperazine, 1-2,3-dichlorophenyl-, monohydrochloride,1-2,3-dichlorophenyl piperazine;hydrochloride,2,3-dichlorophenyl piperazine, chloride,zlchem 392 PubChem CID: 11630372 IUPAC Name: 1-(2,3-dichlorophenyl)piperazine;hydrochloride SMILES: C1CN(CCN1)C2=C(C(=CC=C2)Cl)Cl.Cl
| PubChem CID | 11630372 |
|---|---|
| CAS | 119532-26-2 |
| Molecular Weight (g/mol) | 267.578 |
| MDL Number | MFCD00190238 |
| SMILES | C1CN(CCN1)C2=C(C(=CC=C2)Cl)Cl.Cl |
| Synonym | 1-2,3-dichlorophenyl piperazine hydrochloride,1-2,3-dichlorophenyl piperazine monohydrochloride,1-2,3-dichlorophenyl-piperazine hydrochloride,2,3-dichlorophenylpiperazine hydrochloride,1-2,3-dichlorophenyl-piperazine monohydrochloride,1-2,3-dichlorophenyl piperazinehydrochloride,piperazine, 1-2,3-dichlorophenyl-, monohydrochloride,1-2,3-dichlorophenyl piperazine;hydrochloride,2,3-dichlorophenyl piperazine, chloride,zlchem 392 |
| IUPAC Name | 1-(2,3-dichlorophenyl)piperazine;hydrochloride |
| InChI Key | CYQFNNSFAGXCEC-UHFFFAOYSA-N |
| Molecular Formula | C10H13Cl3N2 |
4-(Chloromethyl)-2-methyl-1,3-thiazole hydrochloride , Tech., Thermo Scientific™
CAS: 77470-53-2 Molecular Formula: C5H7Cl2NS Molecular Weight (g/mol): 184.08 MDL Number: MFCD00067725 InChI Key: YGKDISJLDVGNOR-UHFFFAOYSA-N Synonym: 4-chloromethyl-2-methylthiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole hydrochloride,4-chloromethyl-2-methylthiazole hcl,4-chloromethyl-2-methyl thiazole hydrochloride,2-methyl-4-chloromethyl thiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole, chloride,2-methyl-4-chloromethylthiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole hcl PubChem CID: 2734203 IUPAC Name: 4-(chloromethyl)-2-methyl-1,3-thiazole;hydrochloride SMILES: Cl.CC1=NC(CCl)=CS1
| PubChem CID | 2734203 |
|---|---|
| CAS | 77470-53-2 |
| Molecular Weight (g/mol) | 184.08 |
| MDL Number | MFCD00067725 |
| SMILES | Cl.CC1=NC(CCl)=CS1 |
| Synonym | 4-chloromethyl-2-methylthiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole hydrochloride,4-chloromethyl-2-methylthiazole hcl,4-chloromethyl-2-methyl thiazole hydrochloride,2-methyl-4-chloromethyl thiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole, chloride,2-methyl-4-chloromethylthiazole hydrochloride,4-chloromethyl-2-methyl-1,3-thiazole hcl |
| IUPAC Name | 4-(chloromethyl)-2-methyl-1,3-thiazole;hydrochloride |
| InChI Key | YGKDISJLDVGNOR-UHFFFAOYSA-N |
| Molecular Formula | C5H7Cl2NS |
Pyridine, Low Water, HPLC, J.T. Baker™
CAS: 110-86-1 Molecular Formula: C5H5N Molecular Weight (g/mol): 79.102 InChI Key: JUJWROOIHBZHMG-UHFFFAOYSA-N Synonym: azabenzene,azine,pyridin,piridina,pirydyna,pyridin german,pirydyna polish,piridina italian,rcra waste number u196,caswell no. 717 PubChem CID: 1049 ChEBI: CHEBI:16227 IUPAC Name: pyridine SMILES: C1=CC=NC=C1
| PubChem CID | 1049 |
|---|---|
| CAS | 110-86-1 |
| Molecular Weight (g/mol) | 79.102 |
| ChEBI | CHEBI:16227 |
| SMILES | C1=CC=NC=C1 |
| Synonym | azabenzene,azine,pyridin,piridina,pirydyna,pyridin german,pirydyna polish,piridina italian,rcra waste number u196,caswell no. 717 |
| IUPAC Name | pyridine |
| InChI Key | JUJWROOIHBZHMG-UHFFFAOYSA-N |
| Molecular Formula | C5H5N |
MilliporeSigma™ Bisbenzimide H 33342 Fluorochrome, Trihydrochloride Calbiochem™,
CAS: 23491-52-3 Molecular Formula: C27H28N6O Molecular Weight (g/mol): 452.562 InChI Key: PRDFBSVERLRRMY-UHFFFAOYSA-N Synonym: hoechst 33342,bisbenzimide,hoechst33342,unii-99kzs6cnzx,99kzs6cnzx,2'-4-ethoxyphenyl-5-4-methylpiperazin-1-yl-1h,1'h-2,5'-bibenzo d imidazole,2'-4-ethoxyphenyl-5-4-methyl-1-piperazinyl-2,5'-bi-benzimidazole,2'-4-ethoxyphenyl-5-4-methyl-1-piperazinyl-2,5'-bi-1h-benzimidazole,2'-4'-ethoxyphenyl-5-4-methylpiperazin-1-yl-2,5'-bis-1h-benzimidazole trihydrochloride trihydrate,2'-p-ethoxyphenyl-5-4-methyl-1-piperazinyl-2,5'-bibenzimidazole PubChem CID: 1464 ChEBI: CHEBI:51232 IUPAC Name: 2-(4-ethoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazole SMILES: CCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N6CCN(CC6)C
| PubChem CID | 1464 |
|---|---|
| CAS | 23491-52-3 |
| Molecular Weight (g/mol) | 452.562 |
| ChEBI | CHEBI:51232 |
| SMILES | CCOC1=CC=C(C=C1)C2=NC3=C(N2)C=C(C=C3)C4=NC5=C(N4)C=C(C=C5)N6CCN(CC6)C |
| Synonym | hoechst 33342,bisbenzimide,hoechst33342,unii-99kzs6cnzx,99kzs6cnzx,2'-4-ethoxyphenyl-5-4-methylpiperazin-1-yl-1h,1'h-2,5'-bibenzo d imidazole,2'-4-ethoxyphenyl-5-4-methyl-1-piperazinyl-2,5'-bi-benzimidazole,2'-4-ethoxyphenyl-5-4-methyl-1-piperazinyl-2,5'-bi-1h-benzimidazole,2'-4'-ethoxyphenyl-5-4-methylpiperazin-1-yl-2,5'-bis-1h-benzimidazole trihydrochloride trihydrate,2'-p-ethoxyphenyl-5-4-methyl-1-piperazinyl-2,5'-bibenzimidazole |
| IUPAC Name | 2-(4-ethoxyphenyl)-6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-1H-benzimidazole |
| InChI Key | PRDFBSVERLRRMY-UHFFFAOYSA-N |
| Molecular Formula | C27H28N6O |
Methyl 5-(chloromethyl)-2-furoate, 95%, Thermo Scientific™
CAS: 2144-37-8 Molecular Formula: C7H7ClO3 Molecular Weight (g/mol): 174.58 MDL Number: MFCD00020922 InChI Key: PWXMEBZOKUPCST-UHFFFAOYSA-N Synonym: methyl 5-chloromethyl-2-furoate,methyl 5-chloromethyl furan-2-carboxylate,methyl 5-chloromethyl-2-furancarboxylate,5-chloromethyl-furan-2-carboxylic acid methyl ester,2-furancarboxylic acid, 5-chloromethyl-, methyl ester,5-chloromethylfuran-2-carboxylic acid methyl ester,pubchem24261,enamine_005466,acmc-1ck5d PubChem CID: 75065 IUPAC Name: methyl 5-(chloromethyl)furan-2-carboxylate SMILES: COC(=O)C1=CC=C(O1)CCl
| PubChem CID | 75065 |
|---|---|
| CAS | 2144-37-8 |
| Molecular Weight (g/mol) | 174.58 |
| MDL Number | MFCD00020922 |
| SMILES | COC(=O)C1=CC=C(O1)CCl |
| Synonym | methyl 5-chloromethyl-2-furoate,methyl 5-chloromethyl furan-2-carboxylate,methyl 5-chloromethyl-2-furancarboxylate,5-chloromethyl-furan-2-carboxylic acid methyl ester,2-furancarboxylic acid, 5-chloromethyl-, methyl ester,5-chloromethylfuran-2-carboxylic acid methyl ester,pubchem24261,enamine_005466,acmc-1ck5d |
| IUPAC Name | methyl 5-(chloromethyl)furan-2-carboxylate |
| InChI Key | PWXMEBZOKUPCST-UHFFFAOYSA-N |
| Molecular Formula | C7H7ClO3 |
Pyridoxine hydrochloride, 98%, MP Biomedicals™
CAS: 58-56-0 Molecular Formula: C8H12ClNO3 Molecular Weight (g/mol): 205.638 MDL Number: MFCD00012807 InChI Key: ZUFQODAHGAHPFQ-UHFFFAOYSA-N Synonym: pyridoxine hydrochloride,pyridoxine hcl,pyridoxol hydrochloride,vitamin b6,alestrol,becilan,benadon,hexavibex,hexermin,hexobion PubChem CID: 6019 ChEBI: CHEBI:30961 IUPAC Name: 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride SMILES: CC1=NC=C(C(=C1O)CO)CO.Cl
| PubChem CID | 6019 |
|---|---|
| CAS | 58-56-0 |
| Molecular Weight (g/mol) | 205.638 |
| ChEBI | CHEBI:30961 |
| MDL Number | MFCD00012807 |
| SMILES | CC1=NC=C(C(=C1O)CO)CO.Cl |
| Synonym | pyridoxine hydrochloride,pyridoxine hcl,pyridoxol hydrochloride,vitamin b6,alestrol,becilan,benadon,hexavibex,hexermin,hexobion |
| IUPAC Name | 4,5-bis(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride |
| InChI Key | ZUFQODAHGAHPFQ-UHFFFAOYSA-N |
| Molecular Formula | C8H12ClNO3 |
N-Methylpyridinium-4-carboxaldehyde benzenesulfonate hydrate, 97%
CAS: 82228-89-5 Molecular Formula: C13H13NO4S Molecular Weight (g/mol): 279.31 MDL Number: MFCD00043164 InChI Key: HSVLGIFAXFDLMU-UHFFFAOYSA-M Synonym: 4-formyl-1-methylpyridinium benzenesulfonate,4-formyl-1-methyl-pyridinium benzenesulfonate,4-formyl-1-methylpyridin-1-ium benzenesulfonate,pyridinium, 4-formyl-1-methyl-, benzenesulfonate,benzenesulfonate; 1-methylpyridin-1-ium-4-carbaldehyde,4-formyl-1-methyl pyridinium benzensulfonate,4-formyl-l-methyl pyridinium benzensulfonate,4-formyl-1-methylpyridinium benzenesulfo nate,benzenesulfonic acid, 1-methylpyridine-4-carbaldehyde PubChem CID: 9817127 IUPAC Name: benzenesulfonate;1-methylpyridin-1-ium-4-carbaldehyde SMILES: C[N+]1=CC=C(C=O)C=C1.[O-]S(=O)(=O)C1=CC=CC=C1
| PubChem CID | 9817127 |
|---|---|
| CAS | 82228-89-5 |
| Molecular Weight (g/mol) | 279.31 |
| MDL Number | MFCD00043164 |
| SMILES | C[N+]1=CC=C(C=O)C=C1.[O-]S(=O)(=O)C1=CC=CC=C1 |
| Synonym | 4-formyl-1-methylpyridinium benzenesulfonate,4-formyl-1-methyl-pyridinium benzenesulfonate,4-formyl-1-methylpyridin-1-ium benzenesulfonate,pyridinium, 4-formyl-1-methyl-, benzenesulfonate,benzenesulfonate; 1-methylpyridin-1-ium-4-carbaldehyde,4-formyl-1-methyl pyridinium benzensulfonate,4-formyl-l-methyl pyridinium benzensulfonate,4-formyl-1-methylpyridinium benzenesulfo nate,benzenesulfonic acid, 1-methylpyridine-4-carbaldehyde |
| IUPAC Name | benzenesulfonate;1-methylpyridin-1-ium-4-carbaldehyde |
| InChI Key | HSVLGIFAXFDLMU-UHFFFAOYSA-M |
| Molecular Formula | C13H13NO4S |
3H-1,2-Benzodithiol-one 1,1-dioxide, 98%
CAS: 66304-01-6 Molecular Formula: C7H4O3S2 Molecular Weight (g/mol): 200.226 MDL Number: MFCD00132960 InChI Key: JUDOLRSMWHVKGX-UHFFFAOYSA-N PubChem CID: 3009847 IUPAC Name: 1,1-dioxo-1$l^{6},2-benzodithiol-3-one SMILES: C1=CC=C2C(=C1)C(=O)SS2(=O)=O
| PubChem CID | 3009847 |
|---|---|
| CAS | 66304-01-6 |
| Molecular Weight (g/mol) | 200.226 |
| MDL Number | MFCD00132960 |
| SMILES | C1=CC=C2C(=C1)C(=O)SS2(=O)=O |
| IUPAC Name | 1,1-dioxo-1$l^{6},2-benzodithiol-3-one |
| InChI Key | JUDOLRSMWHVKGX-UHFFFAOYSA-N |
| Molecular Formula | C7H4O3S2 |
2,1,3-Benzothiadiazole-4-carbaldehyde, 95%, Thermo Scientific™
CAS: 5170-68-3 Molecular Formula: C7H4N2OS Molecular Weight (g/mol): 164.182 MDL Number: MFCD02681902 InChI Key: ANVJARPTPIVPRC-UHFFFAOYSA-N Synonym: benzo c 1,2,5 thiadiazole-4-carbaldehyde,2,1,3-benzothiadiazole-4-carboxaldehyde,tos-bb-1233,2,1,3-benzothiadiazol-4-aldehyde,2,1,3-benzothiadiazole-4-aldehyde,2,1,3-benzothiadiazol-4-carboxaldehyde,benzo c 1,2,5-thiadiazole-4-carbaldehyde,2,1,3-benzothiadiazole-4-carbaldehyde PubChem CID: 2776283 IUPAC Name: 2,1,3-benzothiadiazole-4-carbaldehyde SMILES: C1=CC2=NSN=C2C(=C1)C=O
| PubChem CID | 2776283 |
|---|---|
| CAS | 5170-68-3 |
| Molecular Weight (g/mol) | 164.182 |
| MDL Number | MFCD02681902 |
| SMILES | C1=CC2=NSN=C2C(=C1)C=O |
| Synonym | benzo c 1,2,5 thiadiazole-4-carbaldehyde,2,1,3-benzothiadiazole-4-carboxaldehyde,tos-bb-1233,2,1,3-benzothiadiazol-4-aldehyde,2,1,3-benzothiadiazole-4-aldehyde,2,1,3-benzothiadiazol-4-carboxaldehyde,benzo c 1,2,5-thiadiazole-4-carbaldehyde,2,1,3-benzothiadiazole-4-carbaldehyde |
| IUPAC Name | 2,1,3-benzothiadiazole-4-carbaldehyde |
| InChI Key | ANVJARPTPIVPRC-UHFFFAOYSA-N |
| Molecular Formula | C7H4N2OS |
Ethyl 5-(hydroxymethyl)isoxazole-3-carboxylate, 90%, Thermo Scientific™
CAS: 123770-62-7 Molecular Formula: C7H9NO4 Molecular Weight (g/mol): 171.152 MDL Number: MFCD08273501 InChI Key: ZWVVVEYXDQMHGQ-UHFFFAOYSA-N Synonym: ethyl 5-hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-1,2-oxazole-3-carboxylate,5-hydroxymethylisoxazole-3-carboxylic acid ethyl ester,3-isoxazolecarboxylicacid, 5-hydroxymethyl-, ethyl ester,3-isoxazolecarboxylic acid, 5-hydroxymethyl-, ethyl ester,acmc-1c7ap,ethyl 5-hydroxymethylisoxazole-3-carboxylate,ethyl 5 hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-isoxazole-3-carboxylate PubChem CID: 8027233 IUPAC Name: ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate SMILES: CCOC(=O)C1=NOC(=C1)CO
| PubChem CID | 8027233 |
|---|---|
| CAS | 123770-62-7 |
| Molecular Weight (g/mol) | 171.152 |
| MDL Number | MFCD08273501 |
| SMILES | CCOC(=O)C1=NOC(=C1)CO |
| Synonym | ethyl 5-hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-1,2-oxazole-3-carboxylate,5-hydroxymethylisoxazole-3-carboxylic acid ethyl ester,3-isoxazolecarboxylicacid, 5-hydroxymethyl-, ethyl ester,3-isoxazolecarboxylic acid, 5-hydroxymethyl-, ethyl ester,acmc-1c7ap,ethyl 5-hydroxymethylisoxazole-3-carboxylate,ethyl 5 hydroxymethyl isoxazole-3-carboxylate,ethyl 5-hydroxymethyl-isoxazole-3-carboxylate |
| IUPAC Name | ethyl 5-(hydroxymethyl)-1,2-oxazole-3-carboxylate |
| InChI Key | ZWVVVEYXDQMHGQ-UHFFFAOYSA-N |
| Molecular Formula | C7H9NO4 |
6-Chloroimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride, 97%, Thermo Scientific™
CAS: 150020-64-7 Molecular Formula: C5H2Cl2N2O2S2 Molecular Weight (g/mol): 257.103 InChI Key: APRATEMYDZDYJD-UHFFFAOYSA-N PubChem CID: 2799717 IUPAC Name: 6-chloroimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride SMILES: C1=CSC2=NC(=C(N21)S(=O)(=O)Cl)Cl
| PubChem CID | 2799717 |
|---|---|
| CAS | 150020-64-7 |
| Molecular Weight (g/mol) | 257.103 |
| SMILES | C1=CSC2=NC(=C(N21)S(=O)(=O)Cl)Cl |
| IUPAC Name | 6-chloroimidazo[2,1-b][1,3]thiazole-5-sulfonyl chloride |
| InChI Key | APRATEMYDZDYJD-UHFFFAOYSA-N |
| Molecular Formula | C5H2Cl2N2O2S2 |
2-(3-Pyridyl)-1,3-thiazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 39067-29-3 Molecular Formula: C9H6N2O2S Molecular Weight (g/mol): 206.219 MDL Number: MFCD00052304 InChI Key: FOQFGMAZUTUELM-UHFFFAOYSA-N Synonym: 2-pyridin-3-yl thiazole-4-carboxylic acid,2-3-pyridyl-1,3-thiazole-4-carboxylic acid,2-pyridin-3-yl-1,3-thiazole-4-carboxylic acid,4-thiazolecarboxylic acid, 2-3-pyridinyl,2-pyridin-3-yl-thiazole-4-carboxylic acid,2-3-pyridyl thiazole-4-carboxylic acid,2-3-pyridinyl-4-thiazolecarboxylic acid,2-pyrid-3-yl thiazole-4-carboxylic acid,2-3-pyridinyl-1,3-thiazole-4-carboxylic acid PubChem CID: 736513 IUPAC Name: 2-pyridin-3-yl-1,3-thiazole-4-carboxylic acid SMILES: C1=CC(=CN=C1)C2=NC(=CS2)C(=O)O
| PubChem CID | 736513 |
|---|---|
| CAS | 39067-29-3 |
| Molecular Weight (g/mol) | 206.219 |
| MDL Number | MFCD00052304 |
| SMILES | C1=CC(=CN=C1)C2=NC(=CS2)C(=O)O |
| Synonym | 2-pyridin-3-yl thiazole-4-carboxylic acid,2-3-pyridyl-1,3-thiazole-4-carboxylic acid,2-pyridin-3-yl-1,3-thiazole-4-carboxylic acid,4-thiazolecarboxylic acid, 2-3-pyridinyl,2-pyridin-3-yl-thiazole-4-carboxylic acid,2-3-pyridyl thiazole-4-carboxylic acid,2-3-pyridinyl-4-thiazolecarboxylic acid,2-pyrid-3-yl thiazole-4-carboxylic acid,2-3-pyridinyl-1,3-thiazole-4-carboxylic acid |
| IUPAC Name | 2-pyridin-3-yl-1,3-thiazole-4-carboxylic acid |
| InChI Key | FOQFGMAZUTUELM-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O2S |
2,1,3-Benzothiadiazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 3529-57-5 Molecular Formula: C7H4N2O2S Molecular Weight (g/mol): 180.181 MDL Number: MFCD05664666 InChI Key: ZGDGZMOKXTUMEV-UHFFFAOYSA-N Synonym: benzo c 1,2,5 thiadiazole-4-carboxylic acid,4-carboxybenzo-2,1,3-thiadiazole,2,1,3-benzothiadiazole-4-carboxylicacid,1,2,3-benzothiadiazole-4-carboxylic acid,benzo 1,2,5 thiadiazole-4-carboxylic acid,benzo c 1,2,5-thiadiazole-4-carboxylic acid,2,1,3-benzothiadiazole-2-siv-4-carboxylic acid,2??,1,3-benzothiadiazole-4-carboxylic acid PubChem CID: 2795202 IUPAC Name: 2,1,3-benzothiadiazole-4-carboxylic acid SMILES: C1=CC2=NSN=C2C(=C1)C(=O)O
| PubChem CID | 2795202 |
|---|---|
| CAS | 3529-57-5 |
| Molecular Weight (g/mol) | 180.181 |
| MDL Number | MFCD05664666 |
| SMILES | C1=CC2=NSN=C2C(=C1)C(=O)O |
| Synonym | benzo c 1,2,5 thiadiazole-4-carboxylic acid,4-carboxybenzo-2,1,3-thiadiazole,2,1,3-benzothiadiazole-4-carboxylicacid,1,2,3-benzothiadiazole-4-carboxylic acid,benzo 1,2,5 thiadiazole-4-carboxylic acid,benzo c 1,2,5-thiadiazole-4-carboxylic acid,2,1,3-benzothiadiazole-2-siv-4-carboxylic acid,2??,1,3-benzothiadiazole-4-carboxylic acid |
| IUPAC Name | 2,1,3-benzothiadiazole-4-carboxylic acid |
| InChI Key | ZGDGZMOKXTUMEV-UHFFFAOYSA-N |
| Molecular Formula | C7H4N2O2S |