4-[5-(3-azanyl-4-methyl-phenyl)benzimidazol-1-yl]-N-(1-phenylethyl)pyrimidin-2-amine

Systemtic Name: 4-[5-(3-azanyl-4-methyl-phenyl)benzimidazol-1-yl]-N-(1-phenylethyl)pyrimidin-2-amine Openeye Name: 4-[5-(3-amino-4-methyl-phenyl)benzimidazol-1-yl]-N-(1-phenylethyl)pyrimidin-2-amine CAS Name: 4-[5-(3-amino-4-methylphenyl)-1-benzimidazolyl]-N-(1-phenylethyl)-2-pyrimidinamine IUPAC Name: 4-[5-(3-amino-4-methylphenyl)benzimidazol-1-yl]-N-(1-phenylethyl)pyrimidin-2-amine Traditional Name: [4-[5-(3-amino-4-methyl-phenyl)benzimidazol-1-yl]pyrimidin-2-yl]-(1-phenylethyl)amine Formula: C26H24N6 MolecularWeight: 420.50896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC3=C(C=C2)N(C=N3)C4=NC(=NC=C4)NC(C)C5=CC=CC=C5)N

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC3=C(C=C2)N(C=N3)C4=NC(=NC=C4)NC(C)C5=CC=CC=C5)N

InChI

InChI=1S/C26H24N6/c1-17-8-9-20(14-22(17)27)21-10-11-24-23(15-21)29-16-32(24)25-12-13-28-26(31-25)30-18(2)19-6-4-3-5-7-19/h3-16,18H,27H2,1-2H3,(H,28,30,31)