3,5-dimethyl-N-phenyl-pyrazole-1-carbothioamide

Systemtic Name: 3,5-dimethyl-N-phenyl-pyrazole-1-carbothioamide Openeye Name: 3,5-dimethyl-N-phenyl-pyrazole-1-carbothioamide CAS Name: 3,5-dimethyl-N-phenyl-1-pyrazolecarbothioamide IUPAC Name: 3,5-dimethyl-N-phenylpyrazole-1-carbothioamide Traditional Name: 3,5-dimethyl-N-phenyl-pyrazole-1-carbothioamide Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=S)NC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=NN1C(=S)NC2=CC=CC=C2)C

InChI

InChI=1S/C12H13N3S/c1-9-8-10(2)15(14-9)12(16)13-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,16)