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

Systemtic Name: 5-azanyl-1-(4-chloranyl-3-cyano-2-methyl-phenyl)pyrazole-4-carbonitrile Openeye Name: 5-amino-1-(4-chloro-3-cyano-2-methyl-phenyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(4-chloro-3-cyano-2-methylphenyl)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(4-chloro-3-cyano-2-methylphenyl)pyrazole-4-carbonitrile Traditional Name: 5-amino-1-(4-chloro-3-cyano-2-methyl-phenyl)pyrazole-4-carbonitrile Formula: C12H8ClN5 MolecularWeight: 257.67842

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C#N)Cl)N2C(=C(C=N2)C#N)N

Isomeric SMILES

CC1=C(C=CC(=C1C#N)Cl)N2C(=C(C=N2)C#N)N

InChI

InChI=1S/C12H8ClN5/c1-7-9(5-15)10(13)2-3-11(7)18-12(16)8(4-14)6-17-18/h2-3,6H,16H2,1H3