3-[1-[2-[1-(2-propylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]ethyl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[2-[1-(2-propylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[2-[1-(2-propylsulfanylpyridine-3-carbonyl)-4-piperidyl]ethyl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[2-[1-[oxo-[2-(propylthio)-3-pyridinyl]methyl]-4-piperidinyl]ethyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[2-[1-(2-propylsulfanylpyridine-3-carbonyl)piperidin-4-yl]ethyl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[2-[1-[2-(propylthio)nicotinoyl]-4-piperidyl]ethyl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C28H37N5O2S MolecularWeight: 507.69068

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)CCN3CCC(CC3)N4C5=CC=CC=C5NC4=O

Isomeric SMILES

CCCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)CCN3CCC(CC3)N4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C28H37N5O2S/c1-2-20-36-26-23(6-5-14-29-26)27(34)32-18-10-21(11-19-32)9-15-31-16-12-22(13-17-31)33-25-8-4-3-7-24(25)30-28(33)35/h3-8,14,21-22H,2,9-13,15-20H2,1H3,(H,30,35)