N-ethanoyl-N-[2-[2-(4-nitrophenyl)-5-phenyl-pyrazol-3-yl]sulfanylphenyl]ethanamide

Systemtic Name: N-ethanoyl-N-[2-[2-(4-nitrophenyl)-5-phenyl-pyrazol-3-yl]sulfanylphenyl]ethanamide Openeye Name: N-acetyl-N-[2-[2-(4-nitrophenyl)-5-phenyl-pyrazol-3-yl]sulfanylphenyl]acetamide CAS Name: N-acetyl-N-[2-[[2-(4-nitrophenyl)-5-phenyl-3-pyrazolyl]thio]phenyl]acetamide IUPAC Name: N-acetyl-N-[2-[2-(4-nitrophenyl)-5-phenylpyrazol-3-yl]sulfanylphenyl]acetamide Traditional Name: N-acetyl-N-[2-[[2-(4-nitrophenyl)-5-phenyl-pyrazol-3-yl]thio]phenyl]acetamide Formula: C25H20N4O4S MolecularWeight: 472.5157

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1=CC=CC=C1SC2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C(=O)C

Isomeric SMILES

CC(=O)N(C1=CC=CC=C1SC2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C(=O)C

InChI

InChI=1S/C25H20N4O4S/c1-17(30)27(18(2)31)23-10-6-7-11-24(23)34-25-16-22(19-8-4-3-5-9-19)26-28(25)20-12-14-21(15-13-20)29(32)33/h3-16H,1-2H3