(4S,5S)-5-hexyl-4-[(E)-3-methylsulfanylcarbonylsulfanylprop-1-enyl]-3-(phenylmethyl)-1,3-oxazolidin-2-one

Systemtic Name: (4S,5S)-5-hexyl-4-[(E)-3-methylsulfanylcarbonylsulfanylprop-1-enyl]-3-(phenylmethyl)-1,3-oxazolidin-2-one Openeye Name: (4S,5S)-3-benzyl-5-hexyl-4-[(E)-3-methylsulfanylcarbonylsulfanylprop-1-enyl]oxazolidin-2-one CAS Name: (4S,5S)-5-hexyl-4-[(E)-3-[[(methylthio)-oxomethyl]thio]prop-1-enyl]-3-(phenylmethyl)-2-oxazolidinone IUPAC Name: (4S,5S)-3-benzyl-5-hexyl-4-[(E)-3-methylsulfanylcarbonylsulfanylprop-1-enyl]-1,3-oxazolidin-2-one Traditional Name: (4S,5S)-3-benzyl-5-hexyl-4-[(E)-3-[(methylthio)carbonylthio]prop-1-enyl]oxazolidin-2-one Formula: C21H29NO3S2 MolecularWeight: 407.58986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1C(N(C(=O)O1)CC2=CC=CC=C2)C=CCSC(=O)SC

Isomeric SMILES

CCCCCC[C@H]1[C@@H](N(C(=O)O1)CC2=CC=CC=C2)/C=C/CSC(=O)SC

InChI

InChI=1S/C21H29NO3S2/c1-3-4-5-9-14-19-18(13-10-15-27-21(24)26-2)22(20(23)25-19)16-17-11-7-6-8-12-17/h6-8,10-13,18-19H,3-5,9,14-16H2,1-2H3/b13-10+/t18-,19-/m0/s1