methyl N-[(3S,4R)-1-phenyl-3-(phenylmethylsulfanyl)octan-4-yl]carbamate

Systemtic Name: methyl N-[(3S,4R)-1-phenyl-3-(phenylmethylsulfanyl)octan-4-yl]carbamate Openeye Name: methyl N-[(1R)-1-[(1S)-1-benzylsulfanyl-3-phenyl-propyl]pentyl]carbamate CAS Name: N-[(3S,4R)-1-phenyl-3-(phenylmethylthio)octan-4-yl]carbamic acid methyl ester IUPAC Name: methyl N-[(3S,4R)-3-benzylsulfanyl-1-phenyloctan-4-yl]carbamate Traditional Name: N-[(1R)-1-[(1S)-1-(benzylthio)-3-phenyl-propyl]pentyl]carbamic acid methyl ester Formula: C23H31NO2S MolecularWeight: 385.56274

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(CCC1=CC=CC=C1)SCC2=CC=CC=C2)NC(=O)OC

Isomeric SMILES

CCCC[C@H]([C@H](CCC1=CC=CC=C1)SCC2=CC=CC=C2)NC(=O)OC

InChI

InChI=1S/C23H31NO2S/c1-3-4-15-21(24-23(25)26-2)22(17-16-19-11-7-5-8-12-19)27-18-20-13-9-6-10-14-20/h5-14,21-22H,3-4,15-18H2,1-2H3,(H,24,25)/t21-,22+/m1/s1