[4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone

Systemtic Name: [4-(4-bromophenyl)-4-oxidanyl-piperidin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Openeye Name: [4-(4-bromophenyl)-4-hydroxy-1-piperidyl]-(2-methylsulfanyl-3-pyridyl)methanone CAS Name: [4-(4-bromophenyl)-4-hydroxy-1-piperidinyl]-[2-(methylthio)-3-pyridinyl]methanone IUPAC Name: [4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]-(2-methylsulfanylpyridin-3-yl)methanone Traditional Name: [4-(4-bromophenyl)-4-hydroxy-piperidino]-[2-(methylthio)-3-pyridyl]methanone Formula: C18H19BrN2O2S MolecularWeight: 407.32466

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)N2CCC(CC2)(C3=CC=C(C=C3)Br)O

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)N2CCC(CC2)(C3=CC=C(C=C3)Br)O

InChI

InChI=1S/C18H19BrN2O2S/c1-24-16-15(3-2-10-20-16)17(22)21-11-8-18(23,9-12-21)13-4-6-14(19)7-5-13/h2-7,10,23H,8-9,11-12H2,1H3