(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)-(phenylsulfonyl)azanide

Systemtic Name: (4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)-(phenylsulfonyl)azanide Openeye Name: benzenesulfonyl-(4-cyano-5-ethylsulfanyl-1-phenyl-pyrazol-3-yl)azanide CAS Name: benzenesulfonyl-[4-cyano-5-(ethylthio)-1-phenyl-3-pyrazolyl]azanide IUPAC Name: benzenesulfonyl-(4-cyano-5-ethylsulfanyl-1-phenylpyrazol-3-yl)azanide Traditional Name: besyl-[4-cyano-5-(ethylthio)-1-phenyl-pyrazol-3-yl]azanide Formula: C18H15N4O2S2- MolecularWeight: 383.4673

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C(=NN1C2=CC=CC=C2)[N-]S(=O)(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CCSC1=C(C(=NN1C2=CC=CC=C2)[N-]S(=O)(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C18H15N4O2S2/c1-2-25-18-16(13-19)17(20-22(18)14-9-5-3-6-10-14)21-26(23,24)15-11-7-4-8-12-15/h3-12H,2H2,1H3/q-1