5-azanyl-3-methylsulfanyl-1-(phenylmethyl)pyrazole-4-carbonitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=C1C#N)N)CC2=CC=CC=C2

Isomeric SMILES

CSC1=NN(C(=C1C#N)N)CC2=CC=CC=C2

InChI

InChI=1S/C12H12N4S/c1-17-12-10(7-13)11(14)16(15-12)8-9-5-3-2-4-6-9/h2-6H,8,14H2,1H3