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

Systemtic Name: N-[4-[(2R)-2-methyl-3-[(5R)-5-oxidanyl-2-oxidanylidene-azepan-1-yl]propyl]sulfanylphenyl]ethanamide Openeye Name: N-[4-[(2R)-3-[(5R)-5-hydroxy-2-oxo-azepan-1-yl]-2-methyl-propyl]sulfanylphenyl]acetamide CAS Name: N-[4-[[(2R)-3-[(5R)-5-hydroxy-2-oxo-1-azepanyl]-2-methylpropyl]thio]phenyl]acetamide IUPAC Name: N-[4-[(2R)-3-[(5R)-5-hydroxy-2-oxoazepan-1-yl]-2-methylpropyl]sulfanylphenyl]acetamide Traditional Name: N-[4-[[(2R)-3-[(5R)-5-hydroxy-2-keto-azepan-1-yl]-2-methyl-propyl]thio]phenyl]acetamide Formula: C18H26N2O3S MolecularWeight: 350.47564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O3S/c1-13(11-20-10-9-16(22)5-8-18(20)23)12-24-17-6-3-15(4-7-17)19-14(2)21/h3-4,6-7,13,16,22H,5,8-12H2,1-2H3,(H,19,21)/t13-,16-/m1/s1