(phenylmethyl) 2-[[2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylphenyl]carbonylamino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylphenyl]carbonylamino]ethanoate Openeye Name: benzyl 2-[[2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoyl]amino]acetate CAS Name: 2-[[oxo-[2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]phenyl]methyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoyl]amino]acetate Traditional Name: 2-[[2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoyl]amino]acetic acid benzyl ester Formula: C21H24N2O4S MolecularWeight: 400.49126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)NCC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)NCC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H24N2O4S/c1-15(2)23-19(24)14-28-18-11-7-6-10-17(18)21(26)22-12-20(25)27-13-16-8-4-3-5-9-16/h3-11,15H,12-14H2,1-2H3,(H,22,26)(H,23,24)