N-[1,3-bis(oxidanylidene)-2-phenyl-isoindol-5-yl]-2-(phenylmethylsulfanyl)propanamide

Systemtic Name: N-[1,3-bis(oxidanylidene)-2-phenyl-isoindol-5-yl]-2-(phenylmethylsulfanyl)propanamide Openeye Name: 2-benzylsulfanyl-N-(1,3-dioxo-2-phenyl-isoindolin-5-yl)propanamide CAS Name: N-(1,3-dioxo-2-phenyl-5-isoindolyl)-2-(phenylmethylthio)propanamide IUPAC Name: 2-benzylsulfanyl-N-(1,3-dioxo-2-phenylisoindol-5-yl)propanamide Traditional Name: 2-(benzylthio)-N-(1,3-diketo-2-phenyl-isoindolin-5-yl)propionamide Formula: C24H20N2O3S MolecularWeight: 416.4922

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3)SCC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)C(=O)N(C2=O)C3=CC=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C24H20N2O3S/c1-16(30-15-17-8-4-2-5-9-17)22(27)25-18-12-13-20-21(14-18)24(29)26(23(20)28)19-10-6-3-7-11-19/h2-14,16H,15H2,1H3,(H,25,27)