5-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanethioamide

Systemtic Name: 5-[1,3-bis(oxidanylidene)isoindol-2-yl]pentanethioamide Openeye Name: 5-(1,3-dioxoisoindolin-2-yl)pentanethioamide CAS Name: 5-(1,3-dioxo-2-isoindolyl)pentanethioamide IUPAC Name: 5-(1,3-dioxoisoindol-2-yl)pentanethioamide Traditional Name: 5-phthalimidothiovaleramide Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCC(=S)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCC(=S)N

InChI

InChI=1S/C13H14N2O2S/c14-11(18)7-3-4-8-15-12(16)9-5-1-2-6-10(9)13(15)17/h1-2,5-6H,3-4,7-8H2,(H2,14,18)