1-[4-(1H-benzimidazol-2-ylsulfanyl)butanoyl]piperidin-4-one

Systemtic Name: 1-[4-(1H-benzimidazol-2-ylsulfanyl)butanoyl]piperidin-4-one Openeye Name: 1-[4-(1H-benzimidazol-2-ylsulfanyl)butanoyl]piperidin-4-one CAS Name: 1-[4-(1H-benzimidazol-2-ylthio)-1-oxobutyl]-4-piperidinone IUPAC Name: 1-[4-(1H-benzimidazol-2-ylsulfanyl)butanoyl]piperidin-4-one Traditional Name: 1-[4-(1H-benzimidazol-2-ylthio)butanoyl]-4-piperidone Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C(=O)CCCSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C1CN(CCC1=O)C(=O)CCCSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H19N3O2S/c20-12-7-9-19(10-8-12)15(21)6-3-11-22-16-17-13-4-1-2-5-14(13)18-16/h1-2,4-5H,3,6-11H2,(H,17,18)