(2Z)-2-(3-ethyl-1H-benzimidazol-2-ylidene)-2-[5-methyl-2-[(1-methylpiperidin-4-yl)amino]pyrimidin-4-yl]ethanenitrile

Systemtic Name: (2Z)-2-(3-ethyl-1H-benzimidazol-2-ylidene)-2-[5-methyl-2-[(1-methylpiperidin-4-yl)amino]pyrimidin-4-yl]ethanenitrile Openeye Name: (2Z)-2-(3-ethyl-1H-benzimidazol-2-ylidene)-2-[5-methyl-2-[(1-methyl-4-piperidyl)amino]pyrimidin-4-yl]acetonitrile CAS Name: (2Z)-2-(3-ethyl-1H-benzimidazol-2-ylidene)-2-[5-methyl-2-[(1-methyl-4-piperidinyl)amino]-4-pyrimidinyl]acetonitrile IUPAC Name: (2Z)-2-(3-ethyl-1H-benzimidazol-2-ylidene)-2-[5-methyl-2-[(1-methylpiperidin-4-yl)amino]pyrimidin-4-yl]acetonitrile Traditional Name: (2Z)-2-(3-ethyl-1H-benzimidazol-2-ylidene)-2-[5-methyl-2-[(1-methyl-4-piperidyl)amino]pyrimidin-4-yl]acetonitrile Formula: C22H27N7 MolecularWeight: 389.49668

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2NC1=C(C#N)C3=NC(=NC=C3C)NC4CCN(CC4)C

Isomeric SMILES

CCN\1C2=CC=CC=C2N/C1=C(/C#N)\C3=NC(=NC=C3C)NC4CCN(CC4)C

InChI

InChI=1S/C22H27N7/c1-4-29-19-8-6-5-7-18(19)26-21(29)17(13-23)20-15(2)14-24-22(27-20)25-16-9-11-28(3)12-10-16/h5-8,14,16,26H,4,9-12H2,1-3H3,(H,24,25,27)/b21-17+