butyl 3-oxidanylidene-2-phenyl-1H-pyrazole-5-carbodithioate

Systemtic Name: butyl 3-oxidanylidene-2-phenyl-1H-pyrazole-5-carbodithioate Openeye Name: butyl 3-oxo-2-phenyl-1H-pyrazole-5-carbodithioate CAS Name: 3-oxo-2-phenyl-1H-pyrazole-5-carbodithioic acid butyl ester IUPAC Name: butyl 3-oxo-2-phenyl-1H-pyrazole-5-carbodithioate Traditional Name: 5-keto-1-phenyl-3-pyrazoline-3-carbodithioic acid butyl ester Formula: C14H16N2OS2 MolecularWeight: 292.41964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=S)C1=CC(=O)N(N1)C2=CC=CC=C2

Isomeric SMILES

CCCCSC(=S)C1=CC(=O)N(N1)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2OS2/c1-2-3-9-19-14(18)12-10-13(17)16(15-12)11-7-5-4-6-8-11/h4-8,10,15H,2-3,9H2,1H3