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2,4-dimethyl-6-(7-oxidanyl-8-phenoxy-oct-5-ynyl)-2-phenyl-thiomorpholin-3-one

2,4-dimethyl-6-(7-oxidanyl-8-phenoxy-oct-5-ynyl)-2-phenyl-thiomorpholin-3-one

Systemtic Name:2,4-dimethyl-6-(7-oxidanyl-8-phenoxy-oct-5-ynyl)-2-phenyl-thiomorpholin-3-one
Openeye Name:6-(7-hydroxy-8-phenoxy-oct-5-ynyl)-2,4-dimethyl-2-phenyl-thiomorpholin-3-one
CAS Name:6-(7-hydroxy-8-phenoxyoct-5-ynyl)-2,4-dimethyl-2-phenyl-3-thiomorpholinone
IUPAC Name:6-(7-hydroxy-8-phenoxyoct-5-ynyl)-2,4-dimethyl-2-phenylthiomorpholin-3-one
Traditional Name:6-(7-hydroxy-8-phenoxy-oct-5-ynyl)-2,4-dimethyl-2-phenyl-thiomorpholin-3-one
Formula: C26H31NO3S
MolecularWeight: 437.59424
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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(CC(S1)CCCCC#CC(COC2=CC=CC=C2)O)C)C3=CC=CC=C3


Isomeric SMILES

CC1(C(=O)N(CC(S1)CCCCC#CC(COC2=CC=CC=C2)O)C)C3=CC=CC=C3


InChI

InChI=1S/C26H31NO3S/c1-26(21-13-7-5-8-14-21)25(29)27(2)19-24(31-26)18-12-4-3-9-15-22(28)20-30-23-16-10-6-11-17-23/h5-8,10-11,13-14,16-17,22,24,28H,3-4,12,18-20H2,1-2H3


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