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

Systemtic Name: S-(4-chlorophenyl) 2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanethioate Openeye Name: S-(4-chlorophenyl) 2-(1,3-dioxoisoindolin-2-yl)propanethioate CAS Name: 2-(1,3-dioxo-2-isoindolyl)propanethioic acid S-(4-chlorophenyl) ester IUPAC Name: S-(4-chlorophenyl) 2-(1,3-dioxoisoindol-2-yl)propanethioate Traditional Name: 2-phthalimidopropanethioic acid S-(4-chlorophenyl) ester Formula: C17H12ClNO3S MolecularWeight: 345.80008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H12ClNO3S/c1-10(17(22)23-12-8-6-11(18)7-9-12)19-15(20)13-4-2-3-5-14(13)16(19)21/h2-10H,1H3