N-(4-methylsulfanylphenyl)-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide

Systemtic Name: N-(4-methylsulfanylphenyl)-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide Openeye Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-N-(4-methylsulfanylphenyl)acetamide CAS Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-N-[4-(methylthio)phenyl]acetamide IUPAC Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-N-(4-methylsulfanylphenyl)acetamide Traditional Name: 2-[(5S,7R)-3-hydroxy-1-adamantyl]-N-[4-(methylthio)phenyl]acetamide Formula: C19H25NO2S MolecularWeight: 331.4723

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)CC23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)CC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C19H25NO2S/c1-23-16-4-2-15(3-5-16)20-17(21)11-18-7-13-6-14(8-18)10-19(22,9-13)12-18/h2-5,13-14,22H,6-12H2,1H3,(H,20,21)/t13-,14+,18?,19?