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

Systemtic Name: 5-azanyl-1-(6-chloranyl-2-phenyl-pyrimidin-4-yl)-3-methyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(6-chloro-2-phenyl-pyrimidin-4-yl)-3-methyl-pyrazole-4-carbonitrile CAS Name: 5-amino-1-(6-chloro-2-phenyl-4-pyrimidinyl)-3-methyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(6-chloro-2-phenylpyrimidin-4-yl)-3-methylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-(6-chloro-2-phenyl-pyrimidin-4-yl)-3-methyl-pyrazole-4-carbonitrile Formula: C15H11ClN6 MolecularWeight: 310.74104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=NN(C(=C1C#N)N)C2=CC(=NC(=N2)C3=CC=CC=C3)Cl

InChI

InChI=1S/C15H11ClN6/c1-9-11(8-17)14(18)22(21-9)13-7-12(16)19-15(20-13)10-5-3-2-4-6-10/h2-7H,18H2,1H3