5-cyano-N-methyl-1-phenyl-pyrazole-4-carbothioamide

Systemtic Name: 5-cyano-N-methyl-1-phenyl-pyrazole-4-carbothioamide Openeye Name: 5-cyano-N-methyl-1-phenyl-pyrazole-4-carbothioamide CAS Name: 5-cyano-N-methyl-1-phenyl-4-pyrazolecarbothioamide IUPAC Name: 5-cyano-N-methyl-1-phenylpyrazole-4-carbothioamide Traditional Name: 5-cyano-N-methyl-1-phenyl-pyrazole-4-carbothioamide Formula: C12H10N4S MolecularWeight: 242.2996

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)C1=C(N(N=C1)C2=CC=CC=C2)C#N

Isomeric SMILES

CNC(=S)C1=C(N(N=C1)C2=CC=CC=C2)C#N

InChI

InChI=1S/C12H10N4S/c1-14-12(17)10-8-15-16(11(10)7-13)9-5-3-2-4-6-9/h2-6,8H,1H3,(H,14,17)