S-(4-chlorophenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanethioate

Systemtic Name: S-(4-chlorophenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-methyl-butanethioate Openeye Name: S-(4-chlorophenyl) 2-(1,3-dioxoisoindolin-2-yl)-3-methyl-butanethioate CAS Name: 2-(1,3-dioxo-2-isoindolyl)-3-methylbutanethioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 2-(1,3-dioxoisoindol-2-yl)-3-methylbutanethioate Traditional Name: 3-methyl-2-phthalimido-butanethioic acid S-(4-chlorophenyl) ester Formula: C19H16ClNO3S MolecularWeight: 373.85324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)SC1=CC=C(C=C1)Cl)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)C(C(=O)SC1=CC=C(C=C1)Cl)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H16ClNO3S/c1-11(2)16(19(24)25-13-9-7-12(20)8-10-13)21-17(22)14-5-3-4-6-15(14)18(21)23/h3-11,16H,1-2H3