methyl 6-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]hexanoate

Systemtic Name: methyl 6-[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]hexanoate Openeye Name: methyl 6-[(2-phenyl-2-phenylsulfanyl-acetyl)amino]hexanoate CAS Name: 6-[[1-oxo-2-phenyl-2-(phenylthio)ethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[(2-phenyl-2-phenylsulfanylacetyl)amino]hexanoate Traditional Name: 6-[[2-phenyl-2-(phenylthio)acetyl]amino]hexanoic acid methyl ester Formula: C21H25NO3S MolecularWeight: 371.4931

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)C(C1=CC=CC=C1)SC2=CC=CC=C2

Isomeric SMILES

COC(=O)CCCCCNC(=O)C(C1=CC=CC=C1)SC2=CC=CC=C2

InChI

InChI=1S/C21H25NO3S/c1-25-19(23)15-9-4-10-16-22-21(24)20(17-11-5-2-6-12-17)26-18-13-7-3-8-14-18/h2-3,5-8,11-14,20H,4,9-10,15-16H2,1H3,(H,22,24)