(3-methylphenyl)methyl 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate

Systemtic Name: (3-methylphenyl)methyl 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Openeye Name: m-tolylmethyl 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzoic acid (3-methylphenyl)methyl ester IUPAC Name: (3-methylphenyl)methyl 2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoic acid (3-methylbenzyl) ester Formula: C20H23NO3S MolecularWeight: 357.46652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC(=O)C2=CC=CC=C2SCC(=O)NC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)COC(=O)C2=CC=CC=C2SCC(=O)NC(C)C

InChI

InChI=1S/C20H23NO3S/c1-14(2)21-19(22)13-25-18-10-5-4-9-17(18)20(23)24-12-16-8-6-7-15(3)11-16/h4-11,14H,12-13H2,1-3H3,(H,21,22)