methyl 3-[[2-oxidanylidene-1-phenyl-2-[(phenylmethyl)amino]ethyl]-(2-thiophen-2-ylethanoyl)amino]benzoate

Systemtic Name: methyl 3-[[2-oxidanylidene-1-phenyl-2-[(phenylmethyl)amino]ethyl]-(2-thiophen-2-ylethanoyl)amino]benzoate Openeye Name: methyl 3-[[2-(benzylamino)-2-oxo-1-phenyl-ethyl]-[2-(2-thienyl)acetyl]amino]benzoate CAS Name: 3-[[2-oxo-1-phenyl-2-[(phenylmethyl)amino]ethyl]-(1-oxo-2-thiophen-2-ylethyl)amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-(benzylamino)-2-oxo-1-phenylethyl]-(2-thiophen-2-ylacetyl)amino]benzoate Traditional Name: 3-[[2-(benzylamino)-2-keto-1-phenyl-ethyl]-[2-(2-thienyl)acetyl]amino]benzoic acid methyl ester Formula: C29H26N2O4S MolecularWeight: 498.59274

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)N(C(C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)C(=O)CC4=CC=CS4

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)N(C(C2=CC=CC=C2)C(=O)NCC3=CC=CC=C3)C(=O)CC4=CC=CS4

InChI

InChI=1S/C29H26N2O4S/c1-35-29(34)23-14-8-15-24(18-23)31(26(32)19-25-16-9-17-36-25)27(22-12-6-3-7-13-22)28(33)30-20-21-10-4-2-5-11-21/h2-18,27H,19-20H2,1H3,(H,30,33)