phenyl 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate

Systemtic Name: phenyl 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Openeye Name: phenyl 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzoic acid phenyl ester IUPAC Name: phenyl 2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoic acid phenyl ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OC2=CC=CC=C2

InChI

InChI=1S/C18H19NO3S/c1-13(2)19-17(20)12-23-16-11-7-6-10-15(16)18(21)22-14-8-4-3-5-9-14/h3-11,13H,12H2,1-2H3,(H,19,20)