Organoheterocyclic compounds
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2,3-Dimethylthiophene, 97%
CAS: 632-16-6 Molecular Formula: C6H8S Molecular Weight (g/mol): 112.19 MDL Number: MFCD00130081 InChI Key: BZYUMXXOAYSFOW-UHFFFAOYSA-N Synonym: thiophene, 2,3-dimethyl,2,3-dimethyl-thiophene,2,3,dimethylthiophene,pubchem7751,2.3-dimethylthiophene,dimethylthiophene,2,3-dirnethylthiophene PubChem CID: 34295 IUPAC Name: 2,3-dimethylthiophene SMILES: CC1=C(C)C=CS1
| PubChem CID | 34295 |
|---|---|
| CAS | 632-16-6 |
| Molecular Weight (g/mol) | 112.19 |
| MDL Number | MFCD00130081 |
| SMILES | CC1=C(C)C=CS1 |
| Synonym | thiophene, 2,3-dimethyl,2,3-dimethyl-thiophene,2,3,dimethylthiophene,pubchem7751,2.3-dimethylthiophene,dimethylthiophene,2,3-dirnethylthiophene |
| IUPAC Name | 2,3-dimethylthiophene |
| InChI Key | BZYUMXXOAYSFOW-UHFFFAOYSA-N |
| Molecular Formula | C6H8S |
Pyridine, >99%, MP Biomedicals™
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 |
2-Benzothiazoleacetonitrile, 98%
CAS: 56278-50-3 Molecular Formula: C9H6N2S Molecular Weight (g/mol): 174.221 MDL Number: MFCD00051633 InChI Key: ZMZSYUSDGRJZNT-UHFFFAOYSA-N Synonym: benzothiazole-2-acetonitrile,2-benzo d thiazol-2-yl acetonitrile,2-benzothiazoleacetonitrile,2-1,3-benzothiazol-2-yl acetonitrile,benzothiazole-2-yl-acetonitrile,1,3-benzothiazol-2-ylacetonitrile,benzothiazol-2-ylacetonitrile,2-cyanomethyl-1,3-benzothiazole,2-benzothiazol-2-ylethanenitrile,2-cyanomethylbenzothiazole PubChem CID: 342465 IUPAC Name: 2-(1,3-benzothiazol-2-yl)acetonitrile SMILES: C1=CC=C2C(=C1)N=C(S2)CC#N
| PubChem CID | 342465 |
|---|---|
| CAS | 56278-50-3 |
| Molecular Weight (g/mol) | 174.221 |
| MDL Number | MFCD00051633 |
| SMILES | C1=CC=C2C(=C1)N=C(S2)CC#N |
| Synonym | benzothiazole-2-acetonitrile,2-benzo d thiazol-2-yl acetonitrile,2-benzothiazoleacetonitrile,2-1,3-benzothiazol-2-yl acetonitrile,benzothiazole-2-yl-acetonitrile,1,3-benzothiazol-2-ylacetonitrile,benzothiazol-2-ylacetonitrile,2-cyanomethyl-1,3-benzothiazole,2-benzothiazol-2-ylethanenitrile,2-cyanomethylbenzothiazole |
| IUPAC Name | 2-(1,3-benzothiazol-2-yl)acetonitrile |
| InChI Key | ZMZSYUSDGRJZNT-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2S |
Benzimidazole-5,6-dicarboxylic acid, 97%
CAS: 10351-75-4 Molecular Formula: C9H6N2O4 Molecular Weight (g/mol): 206.16 MDL Number: MFCD03093058 InChI Key: PIPQOFRJDBZPFR-UHFFFAOYSA-N Synonym: benzimidazole-5,6-dicarboxylic acid,1h-benzo d imidazole-5,6-dicarboxylic acid,1h-1,3-benzodiazole-5,6-dicarboxylic acid,1h-benzoimidazole-5,6-dicarboxylic,1h-benzoimidazole-5,6-dicarboxylic acid,acmc-1bsyc,5,6-benzimidazoledicarboxylic acid,benzo d imidazole-5,6-dicarboxylic acid PubChem CID: 7023591 IUPAC Name: 1H-benzimidazole-5,6-dicarboxylic acid SMILES: OC(=O)C1=C(C=C2N=CNC2=C1)C(O)=O
| PubChem CID | 7023591 |
|---|---|
| CAS | 10351-75-4 |
| Molecular Weight (g/mol) | 206.16 |
| MDL Number | MFCD03093058 |
| SMILES | OC(=O)C1=C(C=C2N=CNC2=C1)C(O)=O |
| Synonym | benzimidazole-5,6-dicarboxylic acid,1h-benzo d imidazole-5,6-dicarboxylic acid,1h-1,3-benzodiazole-5,6-dicarboxylic acid,1h-benzoimidazole-5,6-dicarboxylic,1h-benzoimidazole-5,6-dicarboxylic acid,acmc-1bsyc,5,6-benzimidazoledicarboxylic acid,benzo d imidazole-5,6-dicarboxylic acid |
| IUPAC Name | 1H-benzimidazole-5,6-dicarboxylic acid |
| InChI Key | PIPQOFRJDBZPFR-UHFFFAOYSA-N |
| Molecular Formula | C9H6N2O4 |
2-Methylthiophene, 98%
CAS: 554-14-3 Molecular Formula: C5H6S Molecular Weight (g/mol): 98.16 MDL Number: MFCD00005451 InChI Key: XQQBUAPQHNYYRS-UHFFFAOYSA-N Synonym: thiophene, 2-methyl,2-methyl thiophene,thiophene, methyl,alpha-methylthiophene,ccris 2936,2-methyl-thiophene,unii-7115jap77a,2-methylthiacyclopentadiene,a-thiotolene,pubchem5204 PubChem CID: 11126 IUPAC Name: 2-methylthiophene SMILES: CC1=CC=CS1
| PubChem CID | 11126 |
|---|---|
| CAS | 554-14-3 |
| Molecular Weight (g/mol) | 98.16 |
| MDL Number | MFCD00005451 |
| SMILES | CC1=CC=CS1 |
| Synonym | thiophene, 2-methyl,2-methyl thiophene,thiophene, methyl,alpha-methylthiophene,ccris 2936,2-methyl-thiophene,unii-7115jap77a,2-methylthiacyclopentadiene,a-thiotolene,pubchem5204 |
| IUPAC Name | 2-methylthiophene |
| InChI Key | XQQBUAPQHNYYRS-UHFFFAOYSA-N |
| Molecular Formula | C5H6S |
3-Thiophenesulfonyl chloride, ≥95%, Thermo Scientific™
CAS: 51175-71-4 Molecular Formula: C4H3ClO2S2 Molecular Weight (g/mol): 182.64 MDL Number: MFCD02682011 InChI Key: YSPWSQNKRBSICH-UHFFFAOYSA-N Synonym: 3-thiophenesulfonyl chloride,3-thiophenesulfonylchloride,chloro-3-thienylsulfone,acmc-209ksa,3-thienylsulfonyl chloride,3-thiophenesulphonylchloride,3-thienyl-sulfonyl chloride,3-chlorosulphonyl thiophene,3-thienyl sulfonyl chloride,3-thiophene sulfonyl chloride PubChem CID: 2776378 IUPAC Name: thiophene-3-sulfonyl chloride SMILES: ClS(=O)(=O)C1=CSC=C1
| PubChem CID | 2776378 |
|---|---|
| CAS | 51175-71-4 |
| Molecular Weight (g/mol) | 182.64 |
| MDL Number | MFCD02682011 |
| SMILES | ClS(=O)(=O)C1=CSC=C1 |
| Synonym | 3-thiophenesulfonyl chloride,3-thiophenesulfonylchloride,chloro-3-thienylsulfone,acmc-209ksa,3-thienylsulfonyl chloride,3-thiophenesulphonylchloride,3-thienyl-sulfonyl chloride,3-chlorosulphonyl thiophene,3-thienyl sulfonyl chloride,3-thiophene sulfonyl chloride |
| IUPAC Name | thiophene-3-sulfonyl chloride |
| InChI Key | YSPWSQNKRBSICH-UHFFFAOYSA-N |
| Molecular Formula | C4H3ClO2S2 |
2-Amino-1,3,4-thiadiazole, 98+%
CAS: 4005-51-0 Molecular Formula: C2H3N3S Molecular Weight (g/mol): 101.127 MDL Number: MFCD00003107 InChI Key: QUKGLNCXGVWCJX-UHFFFAOYSA-N Synonym: 2-amino-1,3,4-thiadiazole,aminothiadiazole,2-aminothiadiazole,atda,aminothiadazole,unii-6l41aok74p,1,3,4-thiadiazole, 2-amino,1,3,4 thiadiazol-2-ylamine,1,3,4-thiadiazol-2-ylamine PubChem CID: 19909 IUPAC Name: 1,3,4-thiadiazol-2-amine SMILES: C1=NN=C(S1)N
| PubChem CID | 19909 |
|---|---|
| CAS | 4005-51-0 |
| Molecular Weight (g/mol) | 101.127 |
| MDL Number | MFCD00003107 |
| SMILES | C1=NN=C(S1)N |
| Synonym | 2-amino-1,3,4-thiadiazole,aminothiadiazole,2-aminothiadiazole,atda,aminothiadazole,unii-6l41aok74p,1,3,4-thiadiazole, 2-amino,1,3,4 thiadiazol-2-ylamine,1,3,4-thiadiazol-2-ylamine |
| IUPAC Name | 1,3,4-thiadiazol-2-amine |
| InChI Key | QUKGLNCXGVWCJX-UHFFFAOYSA-N |
| Molecular Formula | C2H3N3S |
2-Amino-5-phenyl-1,3,4-thiadiazole, 97%
CAS: 2002-03-1 Molecular Formula: C7H6N4S Molecular Weight (g/mol): 178.21 MDL Number: MFCD00205278 InChI Key: KTWDTPBHCWJWGJ-UHFFFAOYSA-N Synonym: 5-pyridin-4-yl-1,3,4-thiadiazol-2-amine,2-amino-5-4-pyridyl-1,3,4-thiadiazole,2-amino-5-4-pyridinyl-1,3,4-thiadiazole,5-4-pyridyl-1,3,4-thiadiazol-2-amine,5-pyridin-4-yl-1,3,4 thiadiazol-2-ylamine,2-amino-5-pyridin-4-yl-1,3,4-thiadiazole,pyridine, 4-2-amino-1,3,4-thiadiazol-5-yl,4-2-amino-1,3,4-thiadiazol-5-yl pyridine,2-amino-5-4-piridil-1,3,4-tiadiazolo,5-4-pyridyl-1,3,4-thiazol-2-yl-amine PubChem CID: 121269 IUPAC Name: 5-pyridin-4-yl-1,3,4-thiadiazol-2-amine SMILES: C1=CN=CC=C1C2=NN=C(S2)N
| PubChem CID | 121269 |
|---|---|
| CAS | 2002-03-1 |
| Molecular Weight (g/mol) | 178.21 |
| MDL Number | MFCD00205278 |
| SMILES | C1=CN=CC=C1C2=NN=C(S2)N |
| Synonym | 5-pyridin-4-yl-1,3,4-thiadiazol-2-amine,2-amino-5-4-pyridyl-1,3,4-thiadiazole,2-amino-5-4-pyridinyl-1,3,4-thiadiazole,5-4-pyridyl-1,3,4-thiadiazol-2-amine,5-pyridin-4-yl-1,3,4 thiadiazol-2-ylamine,2-amino-5-pyridin-4-yl-1,3,4-thiadiazole,pyridine, 4-2-amino-1,3,4-thiadiazol-5-yl,4-2-amino-1,3,4-thiadiazol-5-yl pyridine,2-amino-5-4-piridil-1,3,4-tiadiazolo,5-4-pyridyl-1,3,4-thiazol-2-yl-amine |
| IUPAC Name | 5-pyridin-4-yl-1,3,4-thiadiazol-2-amine |
| InChI Key | KTWDTPBHCWJWGJ-UHFFFAOYSA-N |
| Molecular Formula | C7H6N4S |
Thiophene-2-carboxaldoxime, 98+%
CAS: 29683-84-9 Molecular Formula: C5H5NOS Molecular Weight (g/mol): 127.16 MDL Number: MFCD00022509 InChI Key: GASLBPLHYRZLLT-GQCTYLIASA-N Synonym: thiophene-2-carbaldehyde oxime,2-thiophenecarboxaldehyde, oxime,thiophene-2-carboxaldoxime,thiophene-2-aldoxime,2-thiophenealdehyde oxime,e-n-thiophen-2-ylmethylidene hydroxylamine,e-thiophene-2-carbaldehyde oxime,thiophen-2-aldoxim,pubchem14034,2-formylthiophene oxime PubChem CID: 6876527 IUPAC Name: (NE)-N-(thiophen-2-ylmethylidene)hydroxylamine SMILES: O\N=C\C1=CC=CS1
| PubChem CID | 6876527 |
|---|---|
| CAS | 29683-84-9 |
| Molecular Weight (g/mol) | 127.16 |
| MDL Number | MFCD00022509 |
| SMILES | O\N=C\C1=CC=CS1 |
| Synonym | thiophene-2-carbaldehyde oxime,2-thiophenecarboxaldehyde, oxime,thiophene-2-carboxaldoxime,thiophene-2-aldoxime,2-thiophenealdehyde oxime,e-n-thiophen-2-ylmethylidene hydroxylamine,e-thiophene-2-carbaldehyde oxime,thiophen-2-aldoxim,pubchem14034,2-formylthiophene oxime |
| IUPAC Name | (NE)-N-(thiophen-2-ylmethylidene)hydroxylamine |
| InChI Key | GASLBPLHYRZLLT-GQCTYLIASA-N |
| Molecular Formula | C5H5NOS |
4-(1-Methyl-1H-pyrazol-3-yl)benzonitrile, 97%, Thermo Scientific™
CAS: 915707-41-4 Molecular Formula: C11H9N3 Molecular Weight (g/mol): 183.214 MDL Number: MFCD09702350 InChI Key: OGJIPYGVYSEOQL-UHFFFAOYSA-N Synonym: 4-1-methyl-1h-pyrazol-3-yl benzonitrile,4-1-methylpyrazol-3-yl benzonitrile,4-1-methylpyrazol-3-yl benzenecarbonitrile,benzonitrile,4-1-methyl-1h-pyrazol-3-yl PubChem CID: 24229471 IUPAC Name: 4-(1-methylpyrazol-3-yl)benzonitrile SMILES: CN1C=CC(=N1)C2=CC=C(C=C2)C#N
| PubChem CID | 24229471 |
|---|---|
| CAS | 915707-41-4 |
| Molecular Weight (g/mol) | 183.214 |
| MDL Number | MFCD09702350 |
| SMILES | CN1C=CC(=N1)C2=CC=C(C=C2)C#N |
| Synonym | 4-1-methyl-1h-pyrazol-3-yl benzonitrile,4-1-methylpyrazol-3-yl benzonitrile,4-1-methylpyrazol-3-yl benzenecarbonitrile,benzonitrile,4-1-methyl-1h-pyrazol-3-yl |
| IUPAC Name | 4-(1-methylpyrazol-3-yl)benzonitrile |
| InChI Key | OGJIPYGVYSEOQL-UHFFFAOYSA-N |
| Molecular Formula | C11H9N3 |
5-Azaindole, 98%
CAS: 271-34-1 Molecular Formula: C7H6N2 Molecular Weight (g/mol): 118.139 MDL Number: MFCD00955936 InChI Key: SRSKXJVMVSSSHB-UHFFFAOYSA-N Synonym: 5-azaindole,1h-pyrrolo 3,2-c pyridine,1,5-diazaindene,3,7-dideazapurine,5-azindole,5h-pyrrolo 3,2-c pyridine,pyrrolo 3,2-c pyridine,5-aza indole,5-aza-indole PubChem CID: 9220 IUPAC Name: 1H-pyrrolo[3,2-c]pyridine SMILES: C1=CNC2=C1C=NC=C2
| PubChem CID | 9220 |
|---|---|
| CAS | 271-34-1 |
| Molecular Weight (g/mol) | 118.139 |
| MDL Number | MFCD00955936 |
| SMILES | C1=CNC2=C1C=NC=C2 |
| Synonym | 5-azaindole,1h-pyrrolo 3,2-c pyridine,1,5-diazaindene,3,7-dideazapurine,5-azindole,5h-pyrrolo 3,2-c pyridine,pyrrolo 3,2-c pyridine,5-aza indole,5-aza-indole |
| IUPAC Name | 1H-pyrrolo[3,2-c]pyridine |
| InChI Key | SRSKXJVMVSSSHB-UHFFFAOYSA-N |
| Molecular Formula | C7H6N2 |
5,6,7,8-Tetrahydroquinoxaline, 99%
CAS: 34413-35-9 Molecular Formula: C8H10N2 Molecular Weight (g/mol): 134.182 MDL Number: MFCD00038078 InChI Key: XCZPDOCRSYZOBI-UHFFFAOYSA-N Synonym: cyclohexapyrazine,quinoxaline, 5,6,7,8-tetrahydro,unii-m153cj9ra0,fema no. 3321,5.6.7.8-tetrahydroquinoxaline,nutty quinoxaline,pubchem15475,acmc-209i7e,dsstox_cid_27678,dsstox_rid_82495 PubChem CID: 36822 IUPAC Name: 5,6,7,8-tetrahydroquinoxaline SMILES: C1CCC2=NC=CN=C2C1
| PubChem CID | 36822 |
|---|---|
| CAS | 34413-35-9 |
| Molecular Weight (g/mol) | 134.182 |
| MDL Number | MFCD00038078 |
| SMILES | C1CCC2=NC=CN=C2C1 |
| Synonym | cyclohexapyrazine,quinoxaline, 5,6,7,8-tetrahydro,unii-m153cj9ra0,fema no. 3321,5.6.7.8-tetrahydroquinoxaline,nutty quinoxaline,pubchem15475,acmc-209i7e,dsstox_cid_27678,dsstox_rid_82495 |
| IUPAC Name | 5,6,7,8-tetrahydroquinoxaline |
| InChI Key | XCZPDOCRSYZOBI-UHFFFAOYSA-N |
| Molecular Formula | C8H10N2 |
3-(3-Furyl)acrylic acid, 98%
CAS: 39244-10-5 Molecular Formula: C7H6O3 Molecular Weight (g/mol): 138.12 MDL Number: MFCD00075074 InChI Key: JHAPZUDWRRBZHZ-UHFFFAOYSA-N Synonym: 3-3-furyl acrylic acid,3-furan-3-yl acrylic acid,trans-3-furanacrylic acid,e-3-furan-3-yl acrylic acid,2-propenoic acid, 3-3-furanyl-, 2e,2e-3-3-furyl prop-2-enoic acid,2e-3-furan-3-yl prop-2-enoic acid,3-3-furanyl-2-propenoic acid,2e-3-3-furyl acrylic acid,furan-3-acrylic acid PubChem CID: 643403 IUPAC Name: (E)-3-(furan-3-yl)prop-2-enoic acid SMILES: OC(=O)C=CC1=COC=C1
| PubChem CID | 643403 |
|---|---|
| CAS | 39244-10-5 |
| Molecular Weight (g/mol) | 138.12 |
| MDL Number | MFCD00075074 |
| SMILES | OC(=O)C=CC1=COC=C1 |
| Synonym | 3-3-furyl acrylic acid,3-furan-3-yl acrylic acid,trans-3-furanacrylic acid,e-3-furan-3-yl acrylic acid,2-propenoic acid, 3-3-furanyl-, 2e,2e-3-3-furyl prop-2-enoic acid,2e-3-furan-3-yl prop-2-enoic acid,3-3-furanyl-2-propenoic acid,2e-3-3-furyl acrylic acid,furan-3-acrylic acid |
| IUPAC Name | (E)-3-(furan-3-yl)prop-2-enoic acid |
| InChI Key | JHAPZUDWRRBZHZ-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
3-(1-Methyl-1H-pyrazol-5-yl)aniline, 97%, Thermo Scientific™
CAS: 910037-08-0 Molecular Formula: C10H11N3 Molecular Weight (g/mol): 173.219 MDL Number: MFCD09702400 InChI Key: KEYWGUASUNFUCS-UHFFFAOYSA-N Synonym: 3-1-methyl-1h-pyrazol-5-yl aniline,3-2-methylpyrazol-3-yl aniline,3-1-methylpyrazol-5-yl phenylamine,3-2-methyl-2h-pyrazol-3-yl-phenylamine,benzenamine,3-1-methyl-1h-pyrazol-5-yl PubChem CID: 24229626 IUPAC Name: 3-(2-methylpyrazol-3-yl)aniline SMILES: CN1C(=CC=N1)C2=CC(=CC=C2)N
| PubChem CID | 24229626 |
|---|---|
| CAS | 910037-08-0 |
| Molecular Weight (g/mol) | 173.219 |
| MDL Number | MFCD09702400 |
| SMILES | CN1C(=CC=N1)C2=CC(=CC=C2)N |
| Synonym | 3-1-methyl-1h-pyrazol-5-yl aniline,3-2-methylpyrazol-3-yl aniline,3-1-methylpyrazol-5-yl phenylamine,3-2-methyl-2h-pyrazol-3-yl-phenylamine,benzenamine,3-1-methyl-1h-pyrazol-5-yl |
| IUPAC Name | 3-(2-methylpyrazol-3-yl)aniline |
| InChI Key | KEYWGUASUNFUCS-UHFFFAOYSA-N |
| Molecular Formula | C10H11N3 |