2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(pentan-2-ylamino)pyrimidin-4-yl]ethanenitrile

Systemtic Name: 2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(pentan-2-ylamino)pyrimidin-4-yl]ethanenitrile Openeye Name: 2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(1-methylbutylamino)pyrimidin-4-yl]acetonitrile CAS Name: 2-(1-ethyl-2-benzimidazolyl)-2-[5-methyl-2-(pentan-2-ylamino)-4-pyrimidinyl]acetonitrile IUPAC Name: 2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(pentan-2-ylamino)pyrimidin-4-yl]acetonitrile Traditional Name: 2-(1-ethylbenzimidazol-2-yl)-2-[5-methyl-2-(1-methylbutylamino)pyrimidin-4-yl]acetonitrile Formula: C21H26N6 MolecularWeight: 362.47134

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC1=NC=C(C(=N1)C(C#N)C2=NC3=CC=CC=C3N2CC)C

Isomeric SMILES

CCCC(C)NC1=NC=C(C(=N1)C(C#N)C2=NC3=CC=CC=C3N2CC)C

InChI

InChI=1S/C21H26N6/c1-5-9-15(4)24-21-23-13-14(3)19(26-21)16(12-22)20-25-17-10-7-8-11-18(17)27(20)6-2/h7-8,10-11,13,15-16H,5-6,9H2,1-4H3,(H,23,24,26)