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

Systemtic Name: methyl 4-methyl-5-[(3-nitrophenyl)carbamoyl]-2-[(4-nitrophenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 4-methyl-2-[(4-nitrobenzoyl)amino]-5-[(3-nitrophenyl)carbamoyl]thiophene-3-carboxylate CAS Name: 4-methyl-5-[(3-nitroanilino)-oxomethyl]-2-[[(4-nitrophenyl)-oxomethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-methyl-2-[(4-nitrobenzoyl)amino]-5-[(3-nitrophenyl)carbamoyl]thiophene-3-carboxylate Traditional Name: 4-methyl-2-[(4-nitrobenzoyl)amino]-5-[(3-nitrophenyl)carbamoyl]thiophene-3-carboxylic acid methyl ester Formula: C21H16N4O8S MolecularWeight: 484.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16N4O8S/c1-11-16(21(28)33-2)20(23-18(26)12-6-8-14(9-7-12)24(29)30)34-17(11)19(27)22-13-4-3-5-15(10-13)25(31)32/h3-10H,1-2H3,(H,22,27)(H,23,26)