methyl 4,5-dimethyl-2-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[3-(3-oxidanylidene-4H-quinoxalin-2-yl)propanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[3-(3-oxo-4H-quinoxalin-2-yl)propanoylamino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-3-(3-oxo-4H-quinoxalin-2-yl)propyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[3-(3-oxo-4H-quinoxalin-2-yl)propanoylamino]thiophene-3-carboxylate Traditional Name: 2-[3-(3-keto-4H-quinoxalin-2-yl)propanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC2=NC3=CC=CC=C3NC2=O)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCC2=NC3=CC=CC=C3NC2=O)C

InChI

InChI=1S/C19H19N3O4S/c1-10-11(2)27-18(16(10)19(25)26-3)22-15(23)9-8-14-17(24)21-13-7-5-4-6-12(13)20-14/h4-7H,8-9H2,1-3H3,(H,21,24)(H,22,23)