5-azanyl-1-[6-(2,5-dimethylphenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[6-(2,5-dimethylphenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(2,5-dimethylphenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(2,5-dimethylphenoxy)-2-phenyl-4-pyrimidinyl]-3-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(2,5-dimethylphenoxy)-2-phenylpyrimidin-4-yl]-3-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(2,5-dimethylphenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Formula: C23H20N6O MolecularWeight: 396.4445

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)OC2=NC(=NC(=C2)N3C(=C(C(=N3)C)C#N)N)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(C=C1)C)OC2=NC(=NC(=C2)N3C(=C(C(=N3)C)C#N)N)C4=CC=CC=C4

InChI

InChI=1S/C23H20N6O/c1-14-9-10-15(2)19(11-14)30-21-12-20(29-22(25)18(13-24)16(3)28-29)26-23(27-21)17-7-5-4-6-8-17/h4-12H,25H2,1-3H3