N-[1,3-bis(oxidanylidene)isoindol-5-yl]-4-(phenylmethylsulfanyl)butanamide

Systemtic Name: N-[1,3-bis(oxidanylidene)isoindol-5-yl]-4-(phenylmethylsulfanyl)butanamide Openeye Name: 4-benzylsulfanyl-N-(1,3-dioxoisoindolin-5-yl)butanamide CAS Name: N-(1,3-dioxo-5-isoindolyl)-4-(phenylmethylthio)butanamide IUPAC Name: 4-benzylsulfanyl-N-(1,3-dioxoisoindol-5-yl)butanamide Traditional Name: 4-(benzylthio)-N-(1,3-diketoisoindolin-5-yl)butyramide Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCCC(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

Isomeric SMILES

C1=CC=C(C=C1)CSCCCC(=O)NC2=CC3=C(C=C2)C(=O)NC3=O

InChI

InChI=1S/C19H18N2O3S/c22-17(7-4-10-25-12-13-5-2-1-3-6-13)20-14-8-9-15-16(11-14)19(24)21-18(15)23/h1-3,5-6,8-9,11H,4,7,10,12H2,(H,20,22)(H,21,23,24)