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

Systemtic Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-[(2-phenethylphenyl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-[(2-phenethylbenzoyl)amino]thiophene-3-carboxylate CAS Name: 5-methyl-4-(4-nitrophenyl)-2-[[oxo-(2-phenethylphenyl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-4-(4-nitrophenyl)-2-[(2-phenethylbenzoyl)amino]thiophene-3-carboxylate Traditional Name: 5-methyl-4-(4-nitrophenyl)-2-[(2-phenethylbenzoyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C29H26N2O5S MolecularWeight: 514.59214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)NC(=O)C3=CC=CC=C3CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)[N+](=O)[O-])C)NC(=O)C3=CC=CC=C3CCC4=CC=CC=C4

InChI

InChI=1S/C29H26N2O5S/c1-3-36-29(33)26-25(22-15-17-23(18-16-22)31(34)35)19(2)37-28(26)30-27(32)24-12-8-7-11-21(24)14-13-20-9-5-4-6-10-20/h4-12,15-18H,3,13-14H2,1-2H3,(H,30,32)