2,6-dimethoxy-N-[4-[2-oxidanylidene-2-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]-1-phenyl-ethyl]sulfanylphenyl]benzamide

Systemtic Name: 2,6-dimethoxy-N-[4-[2-oxidanylidene-2-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]-1-phenyl-ethyl]sulfanylphenyl]benzamide Openeye Name: 2,6-dimethoxy-N-[4-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]-1-phenyl-ethyl]sulfanylphenyl]benzamide CAS Name: 2,6-dimethoxy-N-[4-[[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]-1-phenylethyl]thio]phenyl]benzamide IUPAC Name: 2,6-dimethoxy-N-[4-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]-1-phenylethyl]sulfanylphenyl]benzamide Traditional Name: N-[4-[[2-keto-2-[(5-keto-1-phenyl-2-pyrazolin-3-yl)amino]-1-phenyl-ethyl]thio]phenyl]-2,6-dimethoxy-benzamide Formula: C32H28N4O5S MolecularWeight: 580.65352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=NN(C(=O)C4)C5=CC=CC=C5

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=NN(C(=O)C4)C5=CC=CC=C5

InChI

InChI=1S/C32H28N4O5S/c1-40-25-14-9-15-26(41-2)29(25)31(38)33-22-16-18-24(19-17-22)42-30(21-10-5-3-6-11-21)32(39)34-27-20-28(37)36(35-27)23-12-7-4-8-13-23/h3-19,30H,20H2,1-2H3,(H,33,38)(H,34,35,39)