N-[4-[(2R)-3-[(5R)-5-tert-butyl-2-oxidanylidene-azepan-1-yl]-2-methyl-propyl]sulfanylphenyl]ethanamide

Systemtic Name: N-[4-[(2R)-3-[(5R)-5-tert-butyl-2-oxidanylidene-azepan-1-yl]-2-methyl-propyl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[(2R)-3-[(5R)-5-tert-butyl-2-oxo-azepan-1-yl]-2-methyl-propyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[(2R)-3-[(5R)-5-tert-butyl-2-oxo-1-azepanyl]-2-methylpropyl]thio]phenyl]acetamide IUPAC Name: N-[4-[(2R)-3-[(5R)-5-tert-butyl-2-oxoazepan-1-yl]-2-methylpropyl]sulfanylphenyl]acetamide Traditional Name: N-[4-[[(2R)-3-[(5R)-5-tert-butyl-2-keto-azepan-1-yl]-2-methyl-propyl]thio]phenyl]acetamide Formula: C22H34N2O2S MolecularWeight: 390.58256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H34N2O2S/c1-16(15-27-20-9-7-19(8-10-20)23-17(2)25)14-24-13-12-18(22(3,4)5)6-11-21(24)26/h7-10,16,18H,6,11-15H2,1-5H3,(H,23,25)/t16-,18-/m1/s1