1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide

Systemtic Name: 1-[4-chloranyl-3-(trifluoromethyl)phenyl]sulfonyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide Openeye Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-(1-isopropyl-4-piperidyl)piperidine-4-carboxamide CAS Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-(1-propan-2-yl-4-piperidinyl)-4-piperidinecarboxamide IUPAC Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-(1-propan-2-ylpiperidin-4-yl)piperidine-4-carboxamide Traditional Name: 1-[4-chloro-3-(trifluoromethyl)phenyl]sulfonyl-N-(1-isopropyl-4-piperidyl)isonipecotamide Formula: C21H29ClF3N3O3S MolecularWeight: 495.98647

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CC(C)N1CCC(CC1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C21H29ClF3N3O3S/c1-14(2)27-9-7-16(8-10-27)26-20(29)15-5-11-28(12-6-15)32(30,31)17-3-4-19(22)18(13-17)21(23,24)25/h3-4,13-16H,5-12H2,1-2H3,(H,26,29)