2-[4-methyl-2-[3-(1-methylpiperidin-4-yl)propylamino]pyrimidin-5-yl]-3H-benzimidazole-5-carbonitrile

Systemtic Name: 2-[4-methyl-2-[3-(1-methylpiperidin-4-yl)propylamino]pyrimidin-5-yl]-3H-benzimidazole-5-carbonitrile Openeye Name: 2-[4-methyl-2-[3-(1-methyl-4-piperidyl)propylamino]pyrimidin-5-yl]-3H-benzimidazole-5-carbonitrile CAS Name: 2-[4-methyl-2-[3-(1-methyl-4-piperidinyl)propylamino]-5-pyrimidinyl]-3H-benzimidazole-5-carbonitrile IUPAC Name: 2-[4-methyl-2-[3-(1-methylpiperidin-4-yl)propylamino]pyrimidin-5-yl]-3H-benzimidazole-5-carbonitrile Traditional Name: 2-[4-methyl-2-[3-(1-methyl-4-piperidyl)propylamino]pyrimidin-5-yl]-3H-benzimidazole-5-carbonitrile Formula: C22H27N7 MolecularWeight: 389.49668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C2=NC3=C(N2)C=C(C=C3)C#N)NCCCC4CCN(CC4)C

Isomeric SMILES

CC1=NC(=NC=C1C2=NC3=C(N2)C=C(C=C3)C#N)NCCCC4CCN(CC4)C

InChI

InChI=1S/C22H27N7/c1-15-18(21-27-19-6-5-17(13-23)12-20(19)28-21)14-25-22(26-15)24-9-3-4-16-7-10-29(2)11-8-16/h5-6,12,14,16H,3-4,7-11H2,1-2H3,(H,27,28)(H,24,25,26)