methyl 5-methyl-2-[(3-nitrophenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[(3-nitrophenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[(3-nitrobenzoyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[(3-nitrophenyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[(3-nitrobenzoyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-2-[(3-nitrobenzoyl)amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C20H16N2O5S MolecularWeight: 396.41644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H16N2O5S/c1-12-16(13-7-4-3-5-8-13)17(20(24)27-2)19(28-12)21-18(23)14-9-6-10-15(11-14)22(25)26/h3-11H,1-2H3,(H,21,23)