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

Systemtic Name: 4-(1,3-dithian-2-ylidene)-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-(1,3-dithian-2-ylidene)-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-(1,3-dithian-2-ylidene)-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-(1,3-dithian-2-ylidene)-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-(1,3-dithian-2-ylidene)-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C14H14N2OS2 MolecularWeight: 290.40376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C2SCCCS2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=O)C1=C2SCCCS2)C3=CC=CC=C3

InChI

InChI=1S/C14H14N2OS2/c1-10-12(14-18-8-5-9-19-14)13(17)16(15-10)11-6-3-2-4-7-11/h2-4,6-7H,5,8-9H2,1H3