[4-methyl-5-[(4-methylphenyl)carbamoyl]-2-[(4-nitrophenyl)carbonylamino]thiophen-3-yl] propanoate

Systemtic Name: [4-methyl-5-[(4-methylphenyl)carbamoyl]-2-[(4-nitrophenyl)carbonylamino]thiophen-3-yl] propanoate Openeye Name: [4-methyl-2-[(4-nitrobenzoyl)amino]-5-(p-tolylcarbamoyl)-3-thienyl] propanoate CAS Name: propanoic acid [4-methyl-5-[(4-methylanilino)-oxomethyl]-2-[[(4-nitrophenyl)-oxomethyl]amino]-3-thiophenyl] ester IUPAC Name: [4-methyl-5-[(4-methylphenyl)carbamoyl]-2-[(4-nitrobenzoyl)amino]thiophen-3-yl] propanoate Traditional Name: propionic acid [4-methyl-2-[(4-nitrobenzoyl)amino]-5-(p-tolylcarbamoyl)-3-thienyl] ester Formula: C23H21N3O6S MolecularWeight: 467.49434

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)C)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)OC1=C(SC(=C1C)C(=O)NC2=CC=C(C=C2)C)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O6S/c1-4-18(27)32-19-14(3)20(22(29)24-16-9-5-13(2)6-10-16)33-23(19)25-21(28)15-7-11-17(12-8-15)26(30)31/h5-12H,4H2,1-3H3,(H,24,29)(H,25,28)