[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-acetamido-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: [2-(2-cyanoethylamino)-2-oxidanylidene-ethyl] 2-acetamido-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: [2-(2-cyanoethylamino)-2-oxo-ethyl] 2-acetamido-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-acetamido-4-thiophen-2-yl-3-thiophenecarboxylic acid [2-(2-cyanoethylamino)-2-oxoethyl] ester IUPAC Name: [2-(2-cyanoethylamino)-2-oxoethyl] 2-acetamido-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-acetamido-4-(2-thienyl)thiophene-3-carboxylic acid [2-(2-cyanoethylamino)-2-keto-ethyl] ester Formula: C16H15N3O4S2 MolecularWeight: 377.438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=CS1)C2=CC=CS2)C(=O)OCC(=O)NCCC#N

Isomeric SMILES

CC(=O)NC1=C(C(=CS1)C2=CC=CS2)C(=O)OCC(=O)NCCC#N

InChI

InChI=1S/C16H15N3O4S2/c1-10(20)19-15-14(11(9-25-15)12-4-2-7-24-12)16(22)23-8-13(21)18-6-3-5-17/h2,4,7,9H,3,6,8H2,1H3,(H,18,21)(H,19,20)