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

Systemtic Name: methyl 2-[(3-methyl-4-nitro-phenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-methyl-4-nitro-benzoyl)amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(3-methyl-4-nitrophenyl)-oxomethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-methyl-4-nitrobenzoyl)amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(3-methyl-4-nitro-benzoyl)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=CC(=C1)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=C(C(=CS2)C3=CC=CC=C3)C(=O)OC)[N+](=O)[O-]

InChI

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