3-(4,5-dimethyl-1H-benzimidazol-2-yl)-1-[4-(3-methylpyridin-4-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-1-[4-(3-methylpyridin-4-yl)piperazin-1-yl]propan-1-one Openeye Name: 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-1-[4-(3-methyl-4-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-1-[4-(3-methyl-4-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-1-[4-(3-methylpyridin-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-(4,5-dimethyl-1H-benzimidazol-2-yl)-1-[4-(3-methyl-4-pyridyl)piperazino]propan-1-one Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)NC(=N2)CCC(=O)N3CCN(CC3)C4=C(C=NC=C4)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)NC(=N2)CCC(=O)N3CCN(CC3)C4=C(C=NC=C4)C)C

InChI

InChI=1S/C22H27N5O/c1-15-4-5-18-22(17(15)3)25-20(24-18)6-7-21(28)27-12-10-26(11-13-27)19-8-9-23-14-16(19)2/h4-5,8-9,14H,6-7,10-13H2,1-3H3,(H,24,25)