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

Systemtic Name: 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridinyl]thio]-1-[4-(4-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]thio]-1-[4-(4-methoxyphenyl)piperazino]ethanone Formula: C27H29N5O2S MolecularWeight: 487.61646

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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)N4CCN(CC4)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SCC(=O)N4CCN(CC4)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H29N5O2S/c1-18-14-23-24(15-19(18)2)30-27(29-23)20-4-9-25(28-16-20)35-17-26(33)32-12-10-31(11-13-32)21-5-7-22(34-3)8-6-21/h4-9,14-16H,10-13,17H2,1-3H3,(H,29,30)