1-[[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-N-(3-cyclohexylsulfanylpropyl)piperidine-4-carboxamide

Systemtic Name: 1-[[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-N-(3-cyclohexylsulfanylpropyl)piperidine-4-carboxamide Openeye Name: 1-[[2-(3-bromophenyl)-5-methyl-oxazol-4-yl]methyl]-N-(3-cyclohexylsulfanylpropyl)piperidine-4-carboxamide CAS Name: 1-[[2-(3-bromophenyl)-5-methyl-4-oxazolyl]methyl]-N-[3-(cyclohexylthio)propyl]-4-piperidinecarboxamide IUPAC Name: 1-[[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]-N-(3-cyclohexylsulfanylpropyl)piperidine-4-carboxamide Traditional Name: 1-[[2-(3-bromophenyl)-5-methyl-oxazol-4-yl]methyl]-N-[3-(cyclohexylthio)propyl]isonipecotamide Formula: C26H36BrN3O2S MolecularWeight: 534.55194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=CC=C2)Br)CN3CCC(CC3)C(=O)NCCCSC4CCCCC4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=CC=C2)Br)CN3CCC(CC3)C(=O)NCCCSC4CCCCC4

InChI

InChI=1S/C26H36BrN3O2S/c1-19-24(29-26(32-19)21-7-5-8-22(27)17-21)18-30-14-11-20(12-15-30)25(31)28-13-6-16-33-23-9-3-2-4-10-23/h5,7-8,17,20,23H,2-4,6,9-16,18H2,1H3,(H,28,31)