methyl 3-[[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[[2-(2-isopropylanilino)-2-oxo-ethyl]sulfanylmethyl]benzoate CAS Name: 3-[[[2-oxo-2-(2-propan-2-ylanilino)ethyl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[2-oxo-2-(2-propan-2-ylanilino)ethyl]sulfanylmethyl]benzoate Traditional Name: 3-[[[2-(2-isopropylanilino)-2-keto-ethyl]thio]methyl]benzoic acid methyl ester Formula: C20H23NO3S MolecularWeight: 357.46652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)CSCC2=CC=CC(=C2)C(=O)OC

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)CSCC2=CC=CC(=C2)C(=O)OC

InChI

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