methyl 4,5-dimethyl-2-[2-(4-oxidanylidenecinnolin-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-(4-oxidanylidenecinnolin-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-(4-oxo-1-cinnolinyl)ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-(4-oxocinnolin-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-ketocinnolin-1-yl)acetyl]amino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C3=CC=CC=C3C(=O)C=N2)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2C3=CC=CC=C3C(=O)C=N2)C

InChI

InChI=1S/C18H17N3O4S/c1-10-11(2)26-17(16(10)18(24)25-3)20-15(23)9-21-13-7-5-4-6-12(13)14(22)8-19-21/h4-8H,9H2,1-3H3,(H,20,23)