(2S)-4-methylsulfanyl-1,1-diphenyl-2-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-1-ol

Systemtic Name: (2S)-4-methylsulfanyl-1,1-diphenyl-2-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-1-ol Openeye Name: (2S)-4-methylsulfanyl-1,1-diphenyl-2-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-1-ol CAS Name: (2S)-4-(methylthio)-1,1-diphenyl-2-(1,4,7-trioxa-10-azacyclododec-10-yl)-1-butanol IUPAC Name: (2S)-4-methylsulfanyl-1,1-diphenyl-2-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-1-ol Traditional Name: (2S)-4-(methylthio)-1,1-diphenyl-2-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-1-ol Formula: C25H35NO4S MolecularWeight: 445.6147

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(C1=CC=CC=C1)(C2=CC=CC=C2)O)N3CCOCCOCCOCC3

Isomeric SMILES

CSCC[C@@H](C(C1=CC=CC=C1)(C2=CC=CC=C2)O)N3CCOCCOCCOCC3

InChI

InChI=1S/C25H35NO4S/c1-31-21-12-24(26-13-15-28-17-19-30-20-18-29-16-14-26)25(27,22-8-4-2-5-9-22)23-10-6-3-7-11-23/h2-11,24,27H,12-21H2,1H3/t24-/m0/s1