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

Systemtic Name: 4-(1,3-dithiolan-2-ylidene)-2-phenyl-5-propyl-pyrazol-3-one Openeye Name: 4-(1,3-dithiolan-2-ylidene)-2-phenyl-5-propyl-pyrazol-3-one CAS Name: 4-(1,3-dithiolan-2-ylidene)-2-phenyl-5-propyl-3-pyrazolone IUPAC Name: 4-(1,3-dithiolan-2-ylidene)-2-phenyl-5-propylpyrazol-3-one Traditional Name: 4-(1,3-dithiolan-2-ylidene)-2-phenyl-5-propyl-2-pyrazolin-3-one Formula: C15H16N2OS2 MolecularWeight: 304.43034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=O)C1=C2SCCS2)C3=CC=CC=C3

Isomeric SMILES

CCCC1=NN(C(=O)C1=C2SCCS2)C3=CC=CC=C3

InChI

InChI=1S/C15H16N2OS2/c1-2-6-12-13(15-19-9-10-20-15)14(18)17(16-12)11-7-4-3-5-8-11/h3-5,7-8H,2,6,9-10H2,1H3