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

Systemtic Name: 5-azanyl-3-ethyl-1-[2-methyl-6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carbonitrile Openeye Name: 5-amino-3-ethyl-1-[2-methyl-6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carbonitrile CAS Name: 5-amino-3-ethyl-1-[2-methyl-6-(3-methylphenoxy)-4-pyrimidinyl]-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-ethyl-1-[2-methyl-6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carbonitrile Traditional Name: 5-amino-3-ethyl-1-[2-methyl-6-(3-methylphenoxy)pyrimidin-4-yl]pyrazole-4-carbonitrile Formula: C18H18N6O MolecularWeight: 334.37512

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)C)OC3=CC=CC(=C3)C

Isomeric SMILES

CCC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)C)OC3=CC=CC(=C3)C

InChI

InChI=1S/C18H18N6O/c1-4-15-14(10-19)18(20)24(23-15)16-9-17(22-12(3)21-16)25-13-7-5-6-11(2)8-13/h5-9H,4,20H2,1-3H3