N-[(3S)-1-(3-chloranyl-2-methyl-phenyl)sulfonylpiperidin-3-yl]-3-(trifluoromethyl)benzamide

Systemtic Name: N-[(3S)-1-(3-chloranyl-2-methyl-phenyl)sulfonylpiperidin-3-yl]-3-(trifluoromethyl)benzamide Openeye Name: N-[(3S)-1-(3-chloro-2-methyl-phenyl)sulfonyl-3-piperidyl]-3-(trifluoromethyl)benzamide CAS Name: N-[(3S)-1-(3-chloro-2-methylphenyl)sulfonyl-3-piperidinyl]-3-(trifluoromethyl)benzamide IUPAC Name: N-[(3S)-1-(3-chloro-2-methylphenyl)sulfonylpiperidin-3-yl]-3-(trifluoromethyl)benzamide Traditional Name: N-[(3S)-1-(3-chloro-2-methyl-phenyl)sulfonyl-3-piperidyl]-3-(trifluoromethyl)benzamide Formula: C20H20ClF3N2O3S MolecularWeight: 460.89761

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCCC(C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCC[C@@H](C2)NC(=O)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C20H20ClF3N2O3S/c1-13-17(21)8-3-9-18(13)30(28,29)26-10-4-7-16(12-26)25-19(27)14-5-2-6-15(11-14)20(22,23)24/h2-3,5-6,8-9,11,16H,4,7,10,12H2,1H3,(H,25,27)/t16-/m0/s1