N-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylcarbamothioyl]ethanamide

Systemtic Name: N-[(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)methylcarbamothioyl]ethanamide Openeye Name: N-[(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)methylcarbamothioyl]acetamide CAS Name: N-[[(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)methylamino]-sulfanylidenemethyl]acetamide IUPAC Name: N-[(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)methylcarbamothioyl]acetamide Traditional Name: N-[(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)methylthiocarbamoyl]acetamide Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC(=S)NC(=O)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=O)C1=CNC(=S)NC(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C14H14N4O2S/c1-9-12(8-15-14(21)16-10(2)19)13(20)18(17-9)11-6-4-3-5-7-11/h3-8H,1-2H3,(H2,15,16,19,21)