[2-[(3-aminocarbonyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate

Systemtic Name: [2-[(3-aminocarbonyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate Openeye Name: [2-[(3-carbamoyl-5-phenyl-2-thienyl)amino]-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-[(3-carbamoyl-5-phenyl-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-carbamoyl-5-phenylthiophen-2-yl)amino]-2-oxoethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-[(3-carbamoyl-5-phenyl-2-thienyl)amino]-2-keto-ethyl] ester Formula: C19H15N3O4S MolecularWeight: 381.4051

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C(S2)NC(=O)COC(=O)C3=CC=NC=C3)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C(S2)NC(=O)COC(=O)C3=CC=NC=C3)C(=O)N

InChI

InChI=1S/C19H15N3O4S/c20-17(24)14-10-15(12-4-2-1-3-5-12)27-18(14)22-16(23)11-26-19(25)13-6-8-21-9-7-13/h1-10H,11H2,(H2,20,24)(H,22,23)