N-[4-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[4-[2-(3-chloro-4-fluoro-anilino)-2-oxo-1-phenyl-ethyl]sulfanylphenyl]cyclohexanecarboxamide CAS Name: N-[4-[[2-(3-chloro-4-fluoroanilino)-2-oxo-1-phenylethyl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[2-(3-chloro-4-fluoroanilino)-2-oxo-1-phenylethyl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[2-(3-chloro-4-fluoro-anilino)-2-keto-1-phenyl-ethyl]thio]phenyl]cyclohexanecarboxamide Formula: C27H26ClFN2O2S MolecularWeight: 497.023943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SC(C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C27H26ClFN2O2S/c28-23-17-21(13-16-24(23)29)31-27(33)25(18-7-3-1-4-8-18)34-22-14-11-20(12-15-22)30-26(32)19-9-5-2-6-10-19/h1,3-4,7-8,11-17,19,25H,2,5-6,9-10H2,(H,30,32)(H,31,33)