[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-phenyl-2-(thiophen-2-ylcarbonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 3-phenyl-2-(thiophen-2-ylcarbonylamino)propanoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 3-phenyl-2-(thiophene-2-carbonylamino)propanoate CAS Name: 2-[[oxo(thiophen-2-yl)methyl]amino]-3-phenylpropanoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 3-phenyl-2-(thiophene-2-carbonylamino)propanoate Traditional Name: 3-phenyl-2-(2-thenoylamino)propionic acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(=O)NCC2=CC=CC=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)OCC(=O)NCC2=CC=CC=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C23H22N2O4S/c26-21(24-15-18-10-5-2-6-11-18)16-29-23(28)19(14-17-8-3-1-4-9-17)25-22(27)20-12-7-13-30-20/h1-13,19H,14-16H2,(H,24,26)(H,25,27)