3-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(3-cyano-4,5-dimethyl-2-thienyl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(3-cyano-4,5-dimethyl-2-thienyl)carbamoyl]pyrazinoic acid Formula: C13H10N4O3S MolecularWeight: 302.3085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)C2=NC=CN=C2C(=O)O)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)C2=NC=CN=C2C(=O)O)C

InChI

InChI=1S/C13H10N4O3S/c1-6-7(2)21-12(8(6)5-14)17-11(18)9-10(13(19)20)16-4-3-15-9/h3-4H,1-2H3,(H,17,18)(H,19,20)