2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(phenylmethyl)piperidin-1-yl]ethanone

Systemtic Name: 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(phenylmethyl)piperidin-1-yl]ethanone Openeye Name: 1-(4-benzyl-1-piperidyl)-2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]ethanone CAS Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridinyl]thio]-1-[4-(phenylmethyl)-1-piperidinyl]ethanone IUPAC Name: 1-(4-benzylpiperidin-1-yl)-2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanylethanone Traditional Name: 1-(4-benzylpiperidino)-2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]thio]ethanone Formula: C28H30N4OS MolecularWeight: 470.629

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SCC(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SCC(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C28H30N4OS/c1-19-14-24-25(15-20(19)2)31-28(30-24)23-8-9-26(29-17-23)34-18-27(33)32-12-10-22(11-13-32)16-21-6-4-3-5-7-21/h3-9,14-15,17,22H,10-13,16,18H2,1-2H3,(H,30,31)