2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(2-pyrazol-1-ylethylamino)pyrimidin-4-yl]ethanenitrile

Systemtic Name: 2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(2-pyrazol-1-ylethylamino)pyrimidin-4-yl]ethanenitrile Openeye Name: 2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(2-pyrazol-1-ylethylamino)pyrimidin-4-yl]acetonitrile CAS Name: 2-(1-ethyl-2-benzimidazolyl)-2-[5-methyl-2-[2-(1-pyrazolyl)ethylamino]-4-pyrimidinyl]acetonitrile IUPAC Name: 2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(2-pyrazol-1-ylethylamino)pyrimidin-4-yl]acetonitrile Traditional Name: 2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(2-pyrazol-1-ylethylamino)pyrimidin-4-yl]acetonitrile Formula: C21H22N8 MolecularWeight: 386.45298

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C(C#N)C3=NC(=NC=C3C)NCCN4C=CC=N4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1C(C#N)C3=NC(=NC=C3C)NCCN4C=CC=N4

InChI

InChI=1S/C21H22N8/c1-3-29-18-8-5-4-7-17(18)26-20(29)16(13-22)19-15(2)14-24-21(27-19)23-10-12-28-11-6-9-25-28/h4-9,11,14,16H,3,10,12H2,1-2H3,(H,23,24,27)