ethyl 4-cyclopropyl-2-[2-[(2-methyl-3-nitro-phenyl)amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-cyclopropyl-2-[2-[(2-methyl-3-nitro-phenyl)amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-cyclopropyl-2-[[2-(2-methyl-3-nitro-anilino)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-cyclopropyl-2-[[2-(2-methyl-3-nitroanilino)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyclopropyl-2-[[2-(2-methyl-3-nitroanilino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-cyclopropyl-2-[[2-(2-methyl-3-nitro-anilino)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CNC3=C(C(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2CC2)NC(=O)CNC3=C(C(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C19H21N3O5S/c1-3-27-19(24)17-13(12-7-8-12)10-28-18(17)21-16(23)9-20-14-5-4-6-15(11(14)2)22(25)26/h4-6,10,12,20H,3,7-9H2,1-2H3,(H,21,23)