Organoheterocyclic compounds
Filtered Search Results
1-Benzylindole-3-carboxylic acid, 98%, Thermo Scientific™
CAS: 27018-76-4 Molecular Formula: C16H13NO2 Molecular Weight (g/mol): 251.28 MDL Number: MFCD00057094 InChI Key: LVYDDRHDOKXFMW-UHFFFAOYSA-N Synonym: 1-benzyl-1h-indole-3-carboxylic acid,indole-3-carboxylic acid, 1-benzyl,1h-indole-3-carboxylic acid, 1-phenylmethyl,pubchem7313,cbmicro_033327,cambridge id 5791025,5-22-03-00037 beilstein handbook reference,1-benzylindol-3-carboxylic acid,n-benzylindole-3-carboxylic acid,1h-indole-3-carboxylicacid, 1-phenylmethyl PubChem CID: 33671 IUPAC Name: 1-benzylindole-3-carboxylic acid SMILES: C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C(=O)O
| PubChem CID | 33671 |
|---|---|
| CAS | 27018-76-4 |
| Molecular Weight (g/mol) | 251.28 |
| MDL Number | MFCD00057094 |
| SMILES | C1=CC=C(C=C1)CN2C=C(C3=CC=CC=C32)C(=O)O |
| Synonym | 1-benzyl-1h-indole-3-carboxylic acid,indole-3-carboxylic acid, 1-benzyl,1h-indole-3-carboxylic acid, 1-phenylmethyl,pubchem7313,cbmicro_033327,cambridge id 5791025,5-22-03-00037 beilstein handbook reference,1-benzylindol-3-carboxylic acid,n-benzylindole-3-carboxylic acid,1h-indole-3-carboxylicacid, 1-phenylmethyl |
| IUPAC Name | 1-benzylindole-3-carboxylic acid |
| InChI Key | LVYDDRHDOKXFMW-UHFFFAOYSA-N |
| Molecular Formula | C16H13NO2 |
1-(3-Aminopropyl)pyrrolidine, 97%
CAS: 23159-07-1 Molecular Formula: C7H16N2 Molecular Weight (g/mol): 128.219 MDL Number: MFCD00014100 InChI Key: VPBWZBGZWHDNKL-UHFFFAOYSA-N Synonym: 3-pyrrolidin-1-yl propan-1-amine,1-3-aminopropyl pyrrolidine,1-3-aminopropyl-pyrrolidine,1-pyrrolidinepropanamine,n-3-aminopropyl pyrrolidine,3-pyrrolidinopropylamine,3-1-pyrrolidinyl propylamine,pyrrolidine, 1-3-aminopropyl,3-pyrrolidin-1-ylpropylamine,3-1-pyrrolidino propylamine PubChem CID: 31670 IUPAC Name: 3-pyrrolidin-1-ylpropan-1-amine SMILES: C1CCN(C1)CCCN
| PubChem CID | 31670 |
|---|---|
| CAS | 23159-07-1 |
| Molecular Weight (g/mol) | 128.219 |
| MDL Number | MFCD00014100 |
| SMILES | C1CCN(C1)CCCN |
| Synonym | 3-pyrrolidin-1-yl propan-1-amine,1-3-aminopropyl pyrrolidine,1-3-aminopropyl-pyrrolidine,1-pyrrolidinepropanamine,n-3-aminopropyl pyrrolidine,3-pyrrolidinopropylamine,3-1-pyrrolidinyl propylamine,pyrrolidine, 1-3-aminopropyl,3-pyrrolidin-1-ylpropylamine,3-1-pyrrolidino propylamine |
| IUPAC Name | 3-pyrrolidin-1-ylpropan-1-amine |
| InChI Key | VPBWZBGZWHDNKL-UHFFFAOYSA-N |
| Molecular Formula | C7H16N2 |
5-Phenyl-1,3,4-thiadiazole-2-thiol, 96%
CAS: 5585-19-3 Molecular Formula: C8H6N2S2 Molecular Weight (g/mol): 194.27 MDL Number: MFCD01681863 InChI Key: ZTLMHGOWADYAHM-UHFFFAOYSA-N Synonym: 5-phenyl-1,3,4-thiadiazole-2-thiol,1,3,4-thiadiazole-2-thiol, 5-phenyl,5-phenyl-1,3,4-thiadiazole-2 3h-thione,2-mercapto-5-fenil-1,3,4-tiadiazolo italian,2-mercapto-5-phenyl-1,3,4-thiadiazole,2-mercapto-5-fenil-1,3,4-tiadiazolo,d0n3dw,5-phenyl-1,3,4-thiadiazol-2-thiol,5-phenyl-1,3,4-thiadiazol-2-yl hydrosulfide PubChem CID: 3035373 IUPAC Name: 5-phenyl-3H-1,3,4-thiadiazole-2-thione SMILES: S=C1NN=C(S1)C1=CC=CC=C1
| PubChem CID | 3035373 |
|---|---|
| CAS | 5585-19-3 |
| Molecular Weight (g/mol) | 194.27 |
| MDL Number | MFCD01681863 |
| SMILES | S=C1NN=C(S1)C1=CC=CC=C1 |
| Synonym | 5-phenyl-1,3,4-thiadiazole-2-thiol,1,3,4-thiadiazole-2-thiol, 5-phenyl,5-phenyl-1,3,4-thiadiazole-2 3h-thione,2-mercapto-5-fenil-1,3,4-tiadiazolo italian,2-mercapto-5-phenyl-1,3,4-thiadiazole,2-mercapto-5-fenil-1,3,4-tiadiazolo,d0n3dw,5-phenyl-1,3,4-thiadiazol-2-thiol,5-phenyl-1,3,4-thiadiazol-2-yl hydrosulfide |
| IUPAC Name | 5-phenyl-3H-1,3,4-thiadiazole-2-thione |
| InChI Key | ZTLMHGOWADYAHM-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2S2 |
4-(2-Methoxyphenyl)piperidine, 97%, Thermo Scientific™
CAS: 58333-75-8 Molecular Formula: C12H17NO Molecular Weight (g/mol): 191.274 MDL Number: MFCD00277219 InChI Key: SRAVSVBVHDLLPO-UHFFFAOYSA-N PubChem CID: 544738 IUPAC Name: 4-(2-methoxyphenyl)piperidine SMILES: COC1=CC=CC=C1C2CCNCC2
| PubChem CID | 544738 |
|---|---|
| CAS | 58333-75-8 |
| Molecular Weight (g/mol) | 191.274 |
| MDL Number | MFCD00277219 |
| SMILES | COC1=CC=CC=C1C2CCNCC2 |
| IUPAC Name | 4-(2-methoxyphenyl)piperidine |
| InChI Key | SRAVSVBVHDLLPO-UHFFFAOYSA-N |
| Molecular Formula | C12H17NO |
Zinc phthalocyanine, 96%
CAS: 14320-04-8 InChI Key: PODBBOVVOGJETB-UHFFFAOYSA-N Synonym: zinc phthalocyanine,znpc,phthalocyanine zinc,zinc ii phthalocyanine,phthalocyanine, zinc,zinc phthalocyanine, dye content 97 % PubChem CID: 2735172 ChEBI: CHEBI:51218 SMILES: C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.[Zn+2]
| PubChem CID | 2735172 |
|---|---|
| CAS | 14320-04-8 |
| ChEBI | CHEBI:51218 |
| SMILES | C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.[Zn+2] |
| Synonym | zinc phthalocyanine,znpc,phthalocyanine zinc,zinc ii phthalocyanine,phthalocyanine, zinc,zinc phthalocyanine, dye content 97 % |
| InChI Key | PODBBOVVOGJETB-UHFFFAOYSA-N |
Sarafloxacin hydrochloride hydrate, 98%
CAS: 91296-87-6 Molecular Formula: C20H18ClF2N3O3 Molecular Weight (g/mol): 421.829 MDL Number: MFCD11869789 InChI Key: KNWODGJQLCISLC-UHFFFAOYSA-N Synonym: sarafloxacin hydrochloride,sarafloxacin hcl,unii-i36jp4q9df,abbott-56620,i36jp4q9df,sarafloxacin hydrochloride usan,saraflox,dsstox_cid_25939,dsstox_rid_81237 PubChem CID: 56207 IUPAC Name: 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid;hydrochloride SMILES: C1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F.Cl
| PubChem CID | 56207 |
|---|---|
| CAS | 91296-87-6 |
| Molecular Weight (g/mol) | 421.829 |
| MDL Number | MFCD11869789 |
| SMILES | C1CN(CCN1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F.Cl |
| Synonym | sarafloxacin hydrochloride,sarafloxacin hcl,unii-i36jp4q9df,abbott-56620,i36jp4q9df,sarafloxacin hydrochloride usan,saraflox,dsstox_cid_25939,dsstox_rid_81237 |
| IUPAC Name | 6-fluoro-1-(4-fluorophenyl)-4-oxo-7-piperazin-1-ylquinoline-3-carboxylic acid;hydrochloride |
| InChI Key | KNWODGJQLCISLC-UHFFFAOYSA-N |
| Molecular Formula | C20H18ClF2N3O3 |
4-Amino-3,5-dichloropyridine, 97%
CAS: 22889-78-7 Molecular Formula: C5H4Cl2N2 Molecular Weight (g/mol): 163.00 MDL Number: MFCD00125023 InChI Key: ISIQAMHROGZHOV-UHFFFAOYSA-N Synonym: 4-amino-3,5-dichloropyridine,3,5-dichloro-4-aminopyridine,3,5-dichloro-4-pyridinamine,4-pyridinamine, 3,5-dichloro,3,5-dichloro-4-amino pyridine,3,5-dichloro-4-pyridine amine,3,5-dichloro-pyridin-4-ylamine,3,5-dichloro-4-pyridylamine,3,5-dichloropyridin-4-ylamine,4-amino-3,5-dichloro pyridine PubChem CID: 89888 IUPAC Name: 3,5-dichloropyridin-4-amine SMILES: NC1=C(Cl)C=NC=C1Cl
| PubChem CID | 89888 |
|---|---|
| CAS | 22889-78-7 |
| Molecular Weight (g/mol) | 163.00 |
| MDL Number | MFCD00125023 |
| SMILES | NC1=C(Cl)C=NC=C1Cl |
| Synonym | 4-amino-3,5-dichloropyridine,3,5-dichloro-4-aminopyridine,3,5-dichloro-4-pyridinamine,4-pyridinamine, 3,5-dichloro,3,5-dichloro-4-amino pyridine,3,5-dichloro-4-pyridine amine,3,5-dichloro-pyridin-4-ylamine,3,5-dichloro-4-pyridylamine,3,5-dichloropyridin-4-ylamine,4-amino-3,5-dichloro pyridine |
| IUPAC Name | 3,5-dichloropyridin-4-amine |
| InChI Key | ISIQAMHROGZHOV-UHFFFAOYSA-N |
| Molecular Formula | C5H4Cl2N2 |
| CAS | 3-2-3988 |
|---|
5-Methylbenzimidazole, 98%
CAS: 614-97-1 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.166 MDL Number: MFCD00010740 InChI Key: RWXZXCZBMQPOBF-UHFFFAOYSA-N Synonym: 5-methylbenzimidazole,5-methyl-1h-benzo d imidazole,1h-benzimidazole, 5-methyl,5-methyl-1h-benzimidazole,benzimidazole, 5-methyl,ethyl 4-cyanophenylalaninate,1h-benzimidazole, 6-methyl,5-methyl-1h-1,3-benzodiazole,6-methyl-1h-1,3-benzodiazole,5mb PubChem CID: 11979 ChEBI: CHEBI:40205 IUPAC Name: 6-methyl-1H-benzimidazole SMILES: CC1=CC2=C(C=C1)N=CN2
| PubChem CID | 11979 |
|---|---|
| CAS | 614-97-1 |
| Molecular Weight (g/mol) | 132.166 |
| ChEBI | CHEBI:40205 |
| MDL Number | MFCD00010740 |
| SMILES | CC1=CC2=C(C=C1)N=CN2 |
| Synonym | 5-methylbenzimidazole,5-methyl-1h-benzo d imidazole,1h-benzimidazole, 5-methyl,5-methyl-1h-benzimidazole,benzimidazole, 5-methyl,ethyl 4-cyanophenylalaninate,1h-benzimidazole, 6-methyl,5-methyl-1h-1,3-benzodiazole,6-methyl-1h-1,3-benzodiazole,5mb |
| IUPAC Name | 6-methyl-1H-benzimidazole |
| InChI Key | RWXZXCZBMQPOBF-UHFFFAOYSA-N |
| Molecular Formula | C8H8N2 |
2-(Bromomethyl)oxetane, 96%
CAS: 939759-23-6 Molecular Formula: C4H7BrO Molecular Weight (g/mol): 151.00 MDL Number: MFCD08544405 InChI Key: OMXAGUVERXNCSZ-UHFFFAOYNA-N Synonym: 2-bromomethyl oxetane,2-bromomethyl-oxetane,oxetane, 2-bromomethyl,cyclobutane, bromomethyl,2-bromomethyl oxetane oxetane, 2-bromomethyl PubChem CID: 16244494 IUPAC Name: 2-(bromomethyl)oxetane SMILES: BrCC1CCO1
| PubChem CID | 16244494 |
|---|---|
| CAS | 939759-23-6 |
| Molecular Weight (g/mol) | 151.00 |
| MDL Number | MFCD08544405 |
| SMILES | BrCC1CCO1 |
| Synonym | 2-bromomethyl oxetane,2-bromomethyl-oxetane,oxetane, 2-bromomethyl,cyclobutane, bromomethyl,2-bromomethyl oxetane oxetane, 2-bromomethyl |
| IUPAC Name | 2-(bromomethyl)oxetane |
| InChI Key | OMXAGUVERXNCSZ-UHFFFAOYNA-N |
| Molecular Formula | C4H7BrO |
4-Nitro-1H-pyrazole, 97%
CAS: 2075-46-9 Molecular Formula: C3H3N3O2 Molecular Weight (g/mol): 113.08 MDL Number: MFCD00159626 InChI Key: XORHNJQEWQGXCN-UHFFFAOYSA-N Synonym: 4-nitropyrazole,1h-pyrazole, 4-nitro,pyrazole, 4-nitro,4-nitropyrrazole,4-nitropyrazol,4-nitro-pyrazole,4-no2-pyrazole,4-nitro-1h-pyrazol,1h-pyrazole-4-nitro,pubchem14984 PubChem CID: 16376 IUPAC Name: 4-nitro-1H-pyrazole SMILES: [O-][N+](=O)C1=CNN=C1
| PubChem CID | 16376 |
|---|---|
| CAS | 2075-46-9 |
| Molecular Weight (g/mol) | 113.08 |
| MDL Number | MFCD00159626 |
| SMILES | [O-][N+](=O)C1=CNN=C1 |
| Synonym | 4-nitropyrazole,1h-pyrazole, 4-nitro,pyrazole, 4-nitro,4-nitropyrrazole,4-nitropyrazol,4-nitro-pyrazole,4-no2-pyrazole,4-nitro-1h-pyrazol,1h-pyrazole-4-nitro,pubchem14984 |
| IUPAC Name | 4-nitro-1H-pyrazole |
| InChI Key | XORHNJQEWQGXCN-UHFFFAOYSA-N |
| Molecular Formula | C3H3N3O2 |
(2-Morpholinophenyl)methanol, 97%, Thermo Scientific™
CAS: 465514-33-4 Molecular Formula: C11H15NO2 Molecular Weight (g/mol): 193.25 MDL Number: MFCD03086181 InChI Key: MYGVYNRBQSAMIF-UHFFFAOYSA-N Synonym: 2-morpholin-4-yl-phenyl methanol,2-morpholinophenyl methanol,2-morpholin-4-yl phenyl methanol,2-morpholin-4-ylphenyl methanol,benzenemethanol,2-4-morpholinyl,2-morpholinophenylmethanol,2-morpholin-4-ylphenyl methan-1-ol PubChem CID: 2776562 SMILES: OCC1=CC=CC=C1N1CCOCC1
| PubChem CID | 2776562 |
|---|---|
| CAS | 465514-33-4 |
| Molecular Weight (g/mol) | 193.25 |
| MDL Number | MFCD03086181 |
| SMILES | OCC1=CC=CC=C1N1CCOCC1 |
| Synonym | 2-morpholin-4-yl-phenyl methanol,2-morpholinophenyl methanol,2-morpholin-4-yl phenyl methanol,2-morpholin-4-ylphenyl methanol,benzenemethanol,2-4-morpholinyl,2-morpholinophenylmethanol,2-morpholin-4-ylphenyl methan-1-ol |
| InChI Key | MYGVYNRBQSAMIF-UHFFFAOYSA-N |
| Molecular Formula | C11H15NO2 |
Cobalt(II) phthalocyanine
CAS: 3317-67-7 Molecular Formula: C32H16CoN8 Molecular Weight (g/mol): 571.469 MDL Number: MFCD00010718 InChI Key: MPMSMUBQXQALQI-UHFFFAOYSA-N Synonym: cobalt ii phthalocyanine,cobalt phthalocyanine,phthalocyanine cobalt ii,phthalocyanine, cobalt,cobalt ii phthalocyanine, beta-form, dye content 97 % PubChem CID: 2734991 SMILES: C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.[Co+2]
| PubChem CID | 2734991 |
|---|---|
| CAS | 3317-67-7 |
| Molecular Weight (g/mol) | 571.469 |
| MDL Number | MFCD00010718 |
| SMILES | C1=CC=C2C(=C1)C3=NC4=NC(=NC5=C6C=CC=CC6=C([N-]5)N=C7C8=CC=CC=C8C(=N7)N=C2[N-]3)C9=CC=CC=C94.[Co+2] |
| Synonym | cobalt ii phthalocyanine,cobalt phthalocyanine,phthalocyanine cobalt ii,phthalocyanine, cobalt,cobalt ii phthalocyanine, beta-form, dye content 97 % |
| InChI Key | MPMSMUBQXQALQI-UHFFFAOYSA-N |
| Molecular Formula | C32H16CoN8 |
3-Oxo-3,4-dihydro-2H-1,4-benzoxazine-6-sulfonyl chloride, 97%, Thermo Scientific™
CAS: 31794-45-3 Molecular Formula: C8H6ClNO4S Molecular Weight (g/mol): 247.649 MDL Number: MFCD05664887 InChI Key: CGTCULUUVYBAPX-UHFFFAOYSA-N Synonym: 3-oxo-3,4-dihydro-2h-1,4-benzoxazine-6-sulfonyl chloride,2h-1,4-benzoxazine-6-sulfonyl chloride, 3,4-dihydro-3-oxo,3-oxo-3,4-dihydro-2h-benzo b 1,4 oxazine-6-sulfonyl chloride,3,4-dihydro-3-oxo-2h-1,4-benzoxazine-6-sulphonyl chloride,3-oxo-3,4-dihydro-2h-benzo 1,4 oxazine-6-sulfonyl chloride,3-oxo-2,4-dihydro-1,4-benzoxazine-6-sulfonyl chloride,6-chlorosulfonyl-2h,4h-benzo e 1,4-oxazin-3-one,6-chlorosulphonyl-3-oxo-1,4-benzoxazine,3-oxo-3,4-dihydro-2h-1,4-benzooxazine-6-sulfonyl chloride,3-oxo-3,4-dihydro-2h-1,4-benzoxazine-6-sulfonyl ch PubChem CID: 5200229 IUPAC Name: 3-oxo-4H-1,4-benzoxazine-6-sulfonyl chloride SMILES: C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)Cl
| PubChem CID | 5200229 |
|---|---|
| CAS | 31794-45-3 |
| Molecular Weight (g/mol) | 247.649 |
| MDL Number | MFCD05664887 |
| SMILES | C1C(=O)NC2=C(O1)C=CC(=C2)S(=O)(=O)Cl |
| Synonym | 3-oxo-3,4-dihydro-2h-1,4-benzoxazine-6-sulfonyl chloride,2h-1,4-benzoxazine-6-sulfonyl chloride, 3,4-dihydro-3-oxo,3-oxo-3,4-dihydro-2h-benzo b 1,4 oxazine-6-sulfonyl chloride,3,4-dihydro-3-oxo-2h-1,4-benzoxazine-6-sulphonyl chloride,3-oxo-3,4-dihydro-2h-benzo 1,4 oxazine-6-sulfonyl chloride,3-oxo-2,4-dihydro-1,4-benzoxazine-6-sulfonyl chloride,6-chlorosulfonyl-2h,4h-benzo e 1,4-oxazin-3-one,6-chlorosulphonyl-3-oxo-1,4-benzoxazine,3-oxo-3,4-dihydro-2h-1,4-benzooxazine-6-sulfonyl chloride,3-oxo-3,4-dihydro-2h-1,4-benzoxazine-6-sulfonyl ch |
| IUPAC Name | 3-oxo-4H-1,4-benzoxazine-6-sulfonyl chloride |
| InChI Key | CGTCULUUVYBAPX-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO4S |
1-Ethylpyridinium bromide, 99%
CAS: 1906-79-2 Molecular Formula: C7H10BrN Molecular Weight (g/mol): 188.068 MDL Number: MFCD00041999 InChI Key: ABFDKXBSQCTIKH-UHFFFAOYSA-M Synonym: 1-ethylpyridinium bromide,1-ethylpyridin-1-ium bromide,ethylpyridinium bromide,pyridinium, 1-ethyl-, bromide,n-ethylpyridinium bromide,pyridinium, 1-ethyl-, bromide 1:1,pyridineethobromide,ethylpyridiniumbromide,1-ethyl-pyridiniubromide,n-ethyl pyridinium bromide PubChem CID: 15927 IUPAC Name: 1-ethylpyridin-1-ium;bromide SMILES: CC[N+]1=CC=CC=C1.[Br-]
| PubChem CID | 15927 |
|---|---|
| CAS | 1906-79-2 |
| Molecular Weight (g/mol) | 188.068 |
| MDL Number | MFCD00041999 |
| SMILES | CC[N+]1=CC=CC=C1.[Br-] |
| Synonym | 1-ethylpyridinium bromide,1-ethylpyridin-1-ium bromide,ethylpyridinium bromide,pyridinium, 1-ethyl-, bromide,n-ethylpyridinium bromide,pyridinium, 1-ethyl-, bromide 1:1,pyridineethobromide,ethylpyridiniumbromide,1-ethyl-pyridiniubromide,n-ethyl pyridinium bromide |
| IUPAC Name | 1-ethylpyridin-1-ium;bromide |
| InChI Key | ABFDKXBSQCTIKH-UHFFFAOYSA-M |
| Molecular Formula | C7H10BrN |