3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butylsulfanyl]-N-(2-chlorophenyl)propanamide

Systemtic Name: 3-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butylsulfanyl]-N-(2-chlorophenyl)propanamide Openeye Name: N-(2-chlorophenyl)-3-[4-(1,3-dioxoisoindolin-2-yl)butylsulfanyl]propanamide CAS Name: N-(2-chlorophenyl)-3-[4-(1,3-dioxo-2-isoindolyl)butylthio]propanamide IUPAC Name: N-(2-chlorophenyl)-3-[4-(1,3-dioxoisoindol-2-yl)butylsulfanyl]propanamide Traditional Name: N-(2-chlorophenyl)-3-(4-phthalimidobutylthio)propionamide Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCSCCC(=O)NC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCSCCC(=O)NC3=CC=CC=C3Cl

InChI

InChI=1S/C21H21ClN2O3S/c22-17-9-3-4-10-18(17)23-19(25)11-14-28-13-6-5-12-24-20(26)15-7-1-2-8-16(15)21(24)27/h1-4,7-10H,5-6,11-14H2,(H,23,25)