4-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanethioamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanethioamide Openeye Name: 4-(1,3-dioxoisoindolin-2-yl)pentanethioamide CAS Name: 4-(1,3-dioxo-2-isoindolyl)pentanethioamide IUPAC Name: 4-(1,3-dioxoisoindol-2-yl)pentanethioamide Traditional Name: 4-phthalimidothiovaleramide Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=S)N)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(CCC(=S)N)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C13H14N2O2S/c1-8(6-7-11(14)18)15-12(16)9-4-2-3-5-10(9)13(15)17/h2-5,8H,6-7H2,1H3,(H2,14,18)