4-[4-(2-azanylpropan-2-yl)phenyl]-2-[[4-(2-imidazol-1-ylethoxy)phenyl]amino]pyrimidine-5-carbonitrile

Systemtic Name: 4-[4-(2-azanylpropan-2-yl)phenyl]-2-[[4-(2-imidazol-1-ylethoxy)phenyl]amino]pyrimidine-5-carbonitrile Openeye Name: 4-[4-(1-amino-1-methyl-ethyl)phenyl]-2-[4-(2-imidazol-1-ylethoxy)anilino]pyrimidine-5-carbonitrile CAS Name: 4-[4-(2-aminopropan-2-yl)phenyl]-2-[4-[2-(1-imidazolyl)ethoxy]anilino]-5-pyrimidinecarbonitrile IUPAC Name: 4-[4-(2-aminopropan-2-yl)phenyl]-2-[4-(2-imidazol-1-ylethoxy)anilino]pyrimidine-5-carbonitrile Traditional Name: 4-[4-(1-amino-1-methyl-ethyl)phenyl]-2-[4-(2-imidazol-1-ylethoxy)anilino]pyrimidine-5-carbonitrile Formula: C25H25N7O MolecularWeight: 439.5123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)C2=NC(=NC=C2C#N)NC3=CC=C(C=C3)OCCN4C=CN=C4)N

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)C2=NC(=NC=C2C#N)NC3=CC=C(C=C3)OCCN4C=CN=C4)N

InChI

InChI=1S/C25H25N7O/c1-25(2,27)20-5-3-18(4-6-20)23-19(15-26)16-29-24(31-23)30-21-7-9-22(10-8-21)33-14-13-32-12-11-28-17-32/h3-12,16-17H,13-14,27H2,1-2H3,(H,29,30,31)