5-azanyl-3-ethyl-1-[6-(4-methylphenoxy)-2-phenyl-pyrimidin-4-yl]pyrazole-4-carbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)C3=CC=CC=C3)OC4=CC=C(C=C4)C

Isomeric SMILES

CCC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)C3=CC=CC=C3)OC4=CC=C(C=C4)C

InChI

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