2,5-dimethyl-N-phenyl-3-sulfanylidene-1H-pyrazole-4-carboxamide

Systemtic Name: 2,5-dimethyl-N-phenyl-3-sulfanylidene-1H-pyrazole-4-carboxamide Openeye Name: 2,5-dimethyl-N-phenyl-3-thioxo-1H-pyrazole-4-carboxamide CAS Name: 2,5-dimethyl-N-phenyl-3-sulfanylidene-1H-pyrazole-4-carboxamide IUPAC Name: 2,5-dimethyl-N-phenyl-3-sulfanylidene-1H-pyrazole-4-carboxamide Traditional Name: 1,3-dimethyl-N-phenyl-5-thioxo-3-pyrazoline-4-carboxamide Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=S)N(N1)C)C(=O)NC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=S)N(N1)C)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C12H13N3OS/c1-8-10(12(17)15(2)14-8)11(16)13-9-6-4-3-5-7-9/h3-7,14H,1-2H3,(H,13,16)