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

Systemtic Name: propan-2-yl 2-[(3-methyl-4-nitro-phenyl)carbonylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C22H20N2O5S MolecularWeight: 424.4696

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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(C)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C22H20N2O5S/c1-13(2)29-22(26)19-17(15-7-5-4-6-8-15)12-30-21(19)23-20(25)16-9-10-18(24(27)28)14(3)11-16/h4-13H,1-3H3,(H,23,25)