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

Systemtic Name: N-[4-[2-oxidanylidene-2-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[4-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]sulfanylphenyl]cyclohexanecarboxamide CAS Name: N-[4-[[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[2-oxo-2-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)amino]ethyl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[2-keto-2-[(5-keto-1-phenyl-2-pyrazolin-3-yl)amino]ethyl]thio]phenyl]cyclohexanecarboxamide Formula: C24H26N4O3S MolecularWeight: 450.55324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NN(C(=O)C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=NN(C(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C24H26N4O3S/c29-22(26-21-15-23(30)28(27-21)19-9-5-2-6-10-19)16-32-20-13-11-18(12-14-20)25-24(31)17-7-3-1-4-8-17/h2,5-6,9-14,17H,1,3-4,7-8,15-16H2,(H,25,31)(H,26,27,29)