1-methyl-5-phenylsulfanyl-pyrazole-4-carbonitrile

Systemtic Name: 1-methyl-5-phenylsulfanyl-pyrazole-4-carbonitrile Openeye Name: 1-methyl-5-phenylsulfanyl-pyrazole-4-carbonitrile CAS Name: 1-methyl-5-(phenylthio)-4-pyrazolecarbonitrile IUPAC Name: 1-methyl-5-phenylsulfanylpyrazole-4-carbonitrile Traditional Name: 1-methyl-5-(phenylthio)pyrazole-4-carbonitrile Formula: C11H9N3S MolecularWeight: 215.27426

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C#N)SC2=CC=CC=C2

Isomeric SMILES

CN1C(=C(C=N1)C#N)SC2=CC=CC=C2

InChI

InChI=1S/C11H9N3S/c1-14-11(9(7-12)8-13-14)15-10-5-3-2-4-6-10/h2-6,8H,1H3