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

Systemtic Name: 2-methyl-N-[4-[2-oxidanylidene-2-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]sulfanylphenyl]benzamide Openeye Name: 2-methyl-N-[4-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]sulfanylphenyl]benzamide CAS Name: 2-methyl-N-[4-[[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]thio]phenyl]benzamide IUPAC Name: 2-methyl-N-[4-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]sulfanylphenyl]benzamide Traditional Name: N-[4-[[2-keto-2-[(5-keto-1-phenyl-2-pyrazolin-3-yl)amino]ethyl]thio]phenyl]-2-methyl-benzamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NN(C(=O)C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NN(C(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22N4O3S/c1-17-7-5-6-10-21(17)25(32)26-18-11-13-20(14-12-18)33-16-23(30)27-22-15-24(31)29(28-22)19-8-3-2-4-9-19/h2-14H,15-16H2,1H3,(H,26,32)(H,27,28,30)