5-azanyl-1-(2-methylphenyl)-3-methylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-1-(2-methylphenyl)-3-methylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-methylsulfanyl-1-(o-tolyl)pyrazole-4-carbonitrile CAS Name: 5-amino-1-(2-methylphenyl)-3-(methylthio)-4-pyrazolecarbonitrile IUPAC Name: 5-amino-1-(2-methylphenyl)-3-methylsulfanylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-(methylthio)-1-(o-tolyl)pyrazole-4-carbonitrile Formula: C12H12N4S MolecularWeight: 244.31548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=N2)SC)C#N)N

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=N2)SC)C#N)N

InChI

InChI=1S/C12H12N4S/c1-8-5-3-4-6-10(8)16-11(14)9(7-13)12(15-16)17-2/h3-6H,14H2,1-2H3