4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-(4-chlorophenyl)sulfanylethanoate

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl 2-(4-chlorophenyl)sulfanylethanoate Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)butyl 2-(4-chlorophenyl)sulfanylacetate CAS Name: 2-[(4-chlorophenyl)thio]acetic acid 4-(1,3-dioxo-2-isoindolyl)butyl ester IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)butyl 2-(4-chlorophenyl)sulfanylacetate Traditional Name: 2-[(4-chlorophenyl)thio]acetic acid 4-phthalimidobutyl ester Formula: C20H18ClNO4S MolecularWeight: 403.87922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCOC(=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCOC(=O)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClNO4S/c21-14-7-9-15(10-8-14)27-13-18(23)26-12-4-3-11-22-19(24)16-5-1-2-6-17(16)20(22)25/h1-2,5-10H,3-4,11-13H2