1-(1H-benzimidazol-2-yl)-6-piperidin-1-yl-5-sulfanyl-hexan-1-one

Systemtic Name: 1-(1H-benzimidazol-2-yl)-6-piperidin-1-yl-5-sulfanyl-hexan-1-one Openeye Name: 1-(1H-benzimidazol-2-yl)-6-(1-piperidyl)-5-sulfanyl-hexan-1-one CAS Name: 1-(1H-benzimidazol-2-yl)-5-mercapto-6-(1-piperidinyl)-1-hexanone IUPAC Name: 1-(1H-benzimidazol-2-yl)-6-piperidin-1-yl-5-sulfanylhexan-1-one Traditional Name: 1-(1H-benzimidazol-2-yl)-5-mercapto-6-piperidino-hexan-1-one Formula: C18H25N3OS MolecularWeight: 331.4756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CCCC(=O)C2=NC3=CC=CC=C3N2)S

Isomeric SMILES

C1CCN(CC1)CC(CCCC(=O)C2=NC3=CC=CC=C3N2)S

InChI

InChI=1S/C18H25N3OS/c22-17(18-19-15-8-2-3-9-16(15)20-18)10-6-7-14(23)13-21-11-4-1-5-12-21/h2-3,8-9,14,23H,1,4-7,10-13H2,(H,19,20)