2-methyl-N-[[(1S,2R)-2-oxidanylcyclohexyl]methyl]-2-phenylsulfanyl-propanamide

Systemtic Name: 2-methyl-N-[[(1S,2R)-2-oxidanylcyclohexyl]methyl]-2-phenylsulfanyl-propanamide Openeye Name: N-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-2-methyl-2-phenylsulfanyl-propanamide CAS Name: N-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-2-methyl-2-(phenylthio)propanamide IUPAC Name: N-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-2-methyl-2-phenylsulfanylpropanamide Traditional Name: N-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-2-methyl-2-(phenylthio)propionamide Formula: C17H25NO2S MolecularWeight: 307.4509

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NCC1CCCCC1O)SC2=CC=CC=C2

Isomeric SMILES

CC(C)(C(=O)NC[C@@H]1CCCC[C@H]1O)SC2=CC=CC=C2

InChI

InChI=1S/C17H25NO2S/c1-17(2,21-14-9-4-3-5-10-14)16(20)18-12-13-8-6-7-11-15(13)19/h3-5,9-10,13,15,19H,6-8,11-12H2,1-2H3,(H,18,20)/t13-,15+/m0/s1