2-[[3-(ethanoylsulfanylmethyl)-2-oxidanylidene-4-(4-phenoxyphenyl)-1-phenyl-butyl]amino]ethanoate

Systemtic Name: 2-[[3-(ethanoylsulfanylmethyl)-2-oxidanylidene-4-(4-phenoxyphenyl)-1-phenyl-butyl]amino]ethanoate Openeye Name: 2-[[3-(acetylsulfanylmethyl)-2-oxo-4-(4-phenoxyphenyl)-1-phenyl-butyl]amino]acetate CAS Name: 2-[[3-[(acetylthio)methyl]-2-oxo-4-(4-phenoxyphenyl)-1-phenylbutyl]amino]acetate IUPAC Name: 2-[[3-(acetylsulfanylmethyl)-2-oxo-4-(4-phenoxyphenyl)-1-phenylbutyl]amino]acetate Traditional Name: 2-[[3-[(acetylthio)methyl]-2-keto-4-(4-phenoxyphenyl)-1-phenyl-butyl]amino]acetate Formula: C27H26NO5S- MolecularWeight: 476.56404

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C(C3=CC=CC=C3)NCC(=O)[O-]

Isomeric SMILES

CC(=O)SCC(CC1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)C(C3=CC=CC=C3)NCC(=O)[O-]

InChI

InChI=1S/C27H27NO5S/c1-19(29)34-18-22(27(32)26(28-17-25(30)31)21-8-4-2-5-9-21)16-20-12-14-24(15-13-20)33-23-10-6-3-7-11-23/h2-15,22,26,28H,16-18H2,1H3,(H,30,31)/p-1