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

Systemtic Name: 5-azanyl-3-methyl-1-[6-(3-methyl-5-propan-2-yl-phenoxy)-2-phenyl-pyrimidin-4-yl]pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(3-isopropyl-5-methyl-phenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-methyl-1-[6-(3-methyl-5-propan-2-ylphenoxy)-2-phenyl-4-pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-methyl-1-[6-(3-methyl-5-propan-2-ylphenoxy)-2-phenylpyrimidin-4-yl]pyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(3-isopropyl-5-methyl-phenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H24N6O/c1-15(2)19-10-16(3)11-20(12-19)32-23-13-22(31-24(27)21(14-26)17(4)30-31)28-25(29-23)18-8-6-5-7-9-18/h5-13,15H,27H2,1-4H3