4-(1,3-dithiolan-2-ylidene)-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-(1,3-dithiolan-2-ylidene)-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-(1,3-dithiolan-2-ylidene)-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-(1,3-dithiolan-2-ylidene)-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-(1,3-dithiolan-2-ylidene)-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-(1,3-dithiolan-2-ylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C13H12N2OS2 MolecularWeight: 276.37718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C2SCCS2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)C1=C2SCCS2)C3=CC=CC=C3

InChI

InChI=1S/C13H12N2OS2/c1-9-11(13-17-7-8-18-13)12(16)15(14-9)10-5-3-2-4-6-10/h2-6H,7-8H2,1H3