diethyl 3-methyl-5-[[methyl-[(3-nitrophenyl)methyl]carbamoyl]amino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[[methyl-[(3-nitrophenyl)methyl]carbamoyl]amino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[methyl-[(3-nitrophenyl)methyl]carbamoyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[[methyl-[(3-nitrophenyl)methyl]amino]-oxomethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[methyl-[(3-nitrophenyl)methyl]carbamoyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[methyl-(3-nitrobenzyl)carbamoyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)N(C)CC2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)N(C)CC2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O7S/c1-5-29-18(24)15-12(3)16(19(25)30-6-2)31-17(15)21-20(26)22(4)11-13-8-7-9-14(10-13)23(27)28/h7-10H,5-6,11H2,1-4H3,(H,21,26)