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

Systemtic Name: 5-azanyl-3-(2-chloranyl-4-methyl-phenyl)-1-pyridin-4-yl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-(2-chloro-4-methyl-phenyl)-1-(4-pyridyl)pyrazole-4-carbonitrile CAS Name: 5-amino-3-(2-chloro-4-methylphenyl)-1-pyridin-4-yl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-(2-chloro-4-methylphenyl)-1-pyridin-4-ylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-(2-chloro-4-methyl-phenyl)-1-(4-pyridyl)pyrazole-4-carbonitrile Formula: C16H12ClN5 MolecularWeight: 309.75298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NN(C(=C2C#N)N)C3=CC=NC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NN(C(=C2C#N)N)C3=CC=NC=C3)Cl

InChI

InChI=1S/C16H12ClN5/c1-10-2-3-12(14(17)8-10)15-13(9-18)16(19)22(21-15)11-4-6-20-7-5-11/h2-8H,19H2,1H3