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

Systemtic Name: 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(furan-2-ylcarbonyl)piperazin-1-yl]ethanone Openeye Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]sulfanyl]-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridinyl]thio]-1-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[5-(5,6-dimethyl-1H-benzimidazol-2-yl)pyridin-2-yl]sulfanyl-1-[4-(furan-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[[5-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-pyridyl]thio]-1-[4-(2-furoyl)piperazino]ethanone Formula: C25H25N5O3S MolecularWeight: 475.5627

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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)C(=O)C5=CC=CO5

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C3=CN=C(C=C3)SCC(=O)N4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C25H25N5O3S/c1-16-12-19-20(13-17(16)2)28-24(27-19)18-5-6-22(26-14-18)34-15-23(31)29-7-9-30(10-8-29)25(32)21-4-3-11-33-21/h3-6,11-14H,7-10,15H2,1-2H3,(H,27,28)