(5R)-1-[(2R)-3-(4-bromophenyl)sulfanyl-2-methyl-propyl]-5-tert-butyl-azepan-2-one

Systemtic Name: (5R)-1-[(2R)-3-(4-bromophenyl)sulfanyl-2-methyl-propyl]-5-tert-butyl-azepan-2-one Openeye Name: (5R)-1-[(2R)-3-(4-bromophenyl)sulfanyl-2-methyl-propyl]-5-tert-butyl-azepan-2-one CAS Name: (5R)-1-[(2R)-3-[(4-bromophenyl)thio]-2-methylpropyl]-5-tert-butyl-2-azepanone IUPAC Name: (5R)-1-[(2R)-3-(4-bromophenyl)sulfanyl-2-methylpropyl]-5-tert-butylazepan-2-one Traditional Name: (5R)-1-[(2R)-3-[(4-bromophenyl)thio]-2-methyl-propyl]-5-tert-butyl-azepan-2-one Formula: C20H30BrNOS MolecularWeight: 412.4273

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCC(CCC1=O)C(C)(C)C)CSC2=CC=C(C=C2)Br

Isomeric SMILES

C[C@H](CN1CC[C@@H](CCC1=O)C(C)(C)C)CSC2=CC=C(C=C2)Br

InChI

InChI=1S/C20H30BrNOS/c1-15(14-24-18-8-6-17(21)7-9-18)13-22-12-11-16(20(2,3)4)5-10-19(22)23/h6-9,15-16H,5,10-14H2,1-4H3/t15-,16-/m1/s1