[2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(4-methylphenyl)carbonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(2-thiophen-2-ylethylamino)ethyl] 2-(4-methylphenyl)carbonylbenzoate Openeye Name: [2-oxo-2-[2-(2-thienyl)ethylamino]ethyl] 2-(4-methylbenzoyl)benzoate CAS Name: 2-[(4-methylphenyl)-oxomethyl]benzoic acid [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(2-thiophen-2-ylethylamino)ethyl] 2-(4-methylbenzoyl)benzoate Traditional Name: 2-p-toluoylbenzoic acid [2-keto-2-[2-(2-thienyl)ethylamino]ethyl] ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC(=O)NCCC3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC(=O)NCCC3=CC=CS3

InChI

InChI=1S/C23H21NO4S/c1-16-8-10-17(11-9-16)22(26)19-6-2-3-7-20(19)23(27)28-15-21(25)24-13-12-18-5-4-14-29-18/h2-11,14H,12-13,15H2,1H3,(H,24,25)