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

Systemtic Name: 5-azanyl-3-(2-chloranyl-4-methyl-phenyl)-1-(4-methoxyphenyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-3-(2-chloro-4-methyl-phenyl)-1-(4-methoxyphenyl)pyrazole-4-carbonitrile CAS Name: 5-amino-3-(2-chloro-4-methylphenyl)-1-(4-methoxyphenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-(2-chloro-4-methylphenyl)-1-(4-methoxyphenyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-3-(2-chloro-4-methyl-phenyl)-1-(4-methoxyphenyl)pyrazole-4-carbonitrile Formula: C18H15ClN4O MolecularWeight: 338.7909

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H15ClN4O/c1-11-3-8-14(16(19)9-11)17-15(10-20)18(21)23(22-17)12-4-6-13(24-2)7-5-12/h3-9H,21H2,1-2H3