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

Systemtic Name: N-[4-[2-[(3-chloranyl-4-fluoranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]cyclohexanecarboxamide Openeye Name: N-[4-[2-(3-chloro-4-fluoro-anilino)-2-oxo-ethyl]sulfanylphenyl]cyclohexanecarboxamide CAS Name: N-[4-[[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]thio]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]sulfanylphenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[2-(3-chloro-4-fluoro-anilino)-2-keto-ethyl]thio]phenyl]cyclohexanecarboxamide Formula: C21H22ClFN2O2S MolecularWeight: 420.927983

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)SCC(=O)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C21H22ClFN2O2S/c22-18-12-16(8-11-19(18)23)24-20(26)13-28-17-9-6-15(7-10-17)25-21(27)14-4-2-1-3-5-14/h6-12,14H,1-5,13H2,(H,24,26)(H,25,27)