(2S)-4-methylsulfanyl-1,1-diphenyl-2-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-ol

Systemtic Name: (2S)-4-methylsulfanyl-1,1-diphenyl-2-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-ol Openeye Name: (2S)-4-methylsulfanyl-1,1-diphenyl-2-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-ol CAS Name: (2S)-4-(methylthio)-1,1-diphenyl-2-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)-1-butanol IUPAC Name: (2S)-4-methylsulfanyl-1,1-diphenyl-2-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-ol Traditional Name: (2S)-4-(methylthio)-1,1-diphenyl-2-(1,4,7,10-tetraoxa-13-azacyclopentadec-13-yl)butan-1-ol Formula: C27H39NO5S MolecularWeight: 489.66726

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(C1=CC=CC=C1)(C2=CC=CC=C2)O)N3CCOCCOCCOCCOCC3

Isomeric SMILES

CSCC[C@@H](C(C1=CC=CC=C1)(C2=CC=CC=C2)O)N3CCOCCOCCOCCOCC3

InChI

InChI=1S/C27H39NO5S/c1-34-23-12-26(27(29,24-8-4-2-5-9-24)25-10-6-3-7-11-25)28-13-15-30-17-19-32-21-22-33-20-18-31-16-14-28/h2-11,26,29H,12-23H2,1H3/t26-/m0/s1