5-azanyl-1-[(4-methylphenyl)methyl]-3-methylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-[(4-methylphenyl)methyl]-3-methylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-methylsulfanyl-1-(p-tolylmethyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-[(4-methylphenyl)methyl]-3-(methylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[(4-methylphenyl)methyl]-3-methylsulfanylpyrazole-4-carbonitrile Traditional Name: 5-amino-1-(4-methylbenzyl)-3-(methylthio)pyrazole-4-carbonitrile Formula: C13H14N4S MolecularWeight: 258.34206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C(=C(C(=N2)SC)C#N)N

Isomeric SMILES

CC1=CC=C(C=C1)CN2C(=C(C(=N2)SC)C#N)N

InChI

InChI=1S/C13H14N4S/c1-9-3-5-10(6-4-9)8-17-12(15)11(7-14)13(16-17)18-2/h3-6H,8,15H2,1-2H3