3-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]carbonyl-6-(trifluoromethyl)piperidin-2-one

Systemtic Name: 3-[4-(3-bromophenyl)sulfonylpiperazin-1-yl]carbonyl-6-(trifluoromethyl)piperidin-2-one Openeye Name: 3-[4-(3-bromophenyl)sulfonylpiperazine-1-carbonyl]-6-(trifluoromethyl)piperidin-2-one CAS Name: 3-[[4-(3-bromophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-6-(trifluoromethyl)-2-piperidinone IUPAC Name: 3-[4-(3-bromophenyl)sulfonylpiperazine-1-carbonyl]-6-(trifluoromethyl)piperidin-2-one Traditional Name: 3-[4-(3-bromophenyl)sulfonylpiperazine-1-carbonyl]-6-(trifluoromethyl)-2-piperidone Formula: C17H19BrF3N3O4S MolecularWeight: 498.31467

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC(=O)C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br)C(F)(F)F

Isomeric SMILES

C1CC(NC(=O)C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC(=CC=C3)Br)C(F)(F)F

InChI

InChI=1S/C17H19BrF3N3O4S/c18-11-2-1-3-12(10-11)29(27,28)24-8-6-23(7-9-24)16(26)13-4-5-14(17(19,20)21)22-15(13)25/h1-3,10,13-14H,4-9H2,(H,22,25)