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

Systemtic Name: 5-azanyl-1-[6-(4-chloranyl-2-methyl-phenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-[6-(4-chloro-2-methyl-phenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-[6-(4-chloro-2-methylphenoxy)-2-phenyl-4-pyrimidinyl]-3-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[6-(4-chloro-2-methylphenoxy)-2-phenylpyrimidin-4-yl]-3-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-[6-(4-chloro-2-methyl-phenoxy)-2-phenyl-pyrimidin-4-yl]-3-methyl-pyrazole-4-carbonitrile Formula: C22H17ClN6O MolecularWeight: 416.86298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17ClN6O/c1-13-10-16(23)8-9-18(13)30-20-11-19(29-21(25)17(12-24)14(2)28-29)26-22(27-20)15-6-4-3-5-7-15/h3-11H,25H2,1-2H3