2-[2-(cyclopropylamino)pyrimidin-4-yl]-2-(1-ethylbenzimidazol-2-yl)ethanenitrile

Systemtic Name: 2-[2-(cyclopropylamino)pyrimidin-4-yl]-2-(1-ethylbenzimidazol-2-yl)ethanenitrile Openeye Name: 2-[2-(cyclopropylamino)pyrimidin-4-yl]-2-(1-ethylbenzimidazol-2-yl)acetonitrile CAS Name: 2-[2-(cyclopropylamino)-4-pyrimidinyl]-2-(1-ethyl-2-benzimidazolyl)acetonitrile IUPAC Name: 2-[2-(cyclopropylamino)pyrimidin-4-yl]-2-(1-ethylbenzimidazol-2-yl)acetonitrile Traditional Name: 2-[2-(cyclopropylamino)pyrimidin-4-yl]-2-(1-ethylbenzimidazol-2-yl)acetonitrile Formula: C18H18N6 MolecularWeight: 318.37572

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1C(C#N)C3=NC(=NC=C3)NC4CC4

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1C(C#N)C3=NC(=NC=C3)NC4CC4

InChI

InChI=1S/C18H18N6/c1-2-24-16-6-4-3-5-15(16)22-17(24)13(11-19)14-9-10-20-18(23-14)21-12-7-8-12/h3-6,9-10,12-13H,2,7-8H2,1H3,(H,20,21,23)