tert-butyl 2-[[4-(1-cyclohexyloxy-1-oxidanylidene-propan-2-yl)-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: tert-butyl 2-[[4-(1-cyclohexyloxy-1-oxidanylidene-propan-2-yl)-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: tert-butyl 2-[[4-[2-(cyclohexoxy)-1-methyl-2-oxo-ethyl]-2-(o-tolyl)benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[4-(1-cyclohexyloxy-1-oxopropan-2-yl)-2-(2-methylphenyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[4-(1-cyclohexyloxy-1-oxopropan-2-yl)-2-(2-methylphenyl)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[4-[2-(cyclohexoxy)-2-keto-1-methyl-ethyl]-2-(o-tolyl)benzoyl]amino]-4-(methylthio)butyric acid tert-butyl ester Formula: C32H43NO5S MolecularWeight: 553.75252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=C(C=CC(=C2)C(C)C(=O)OC3CCCCC3)C(=O)NC(CCSC)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C2=C(C=CC(=C2)C(C)C(=O)OC3CCCCC3)C(=O)NC(CCSC)C(=O)OC(C)(C)C

InChI

InChI=1S/C32H43NO5S/c1-21-12-10-11-15-25(21)27-20-23(22(2)30(35)37-24-13-8-7-9-14-24)16-17-26(27)29(34)33-28(18-19-39-6)31(36)38-32(3,4)5/h10-12,15-17,20,22,24,28H,7-9,13-14,18-19H2,1-6H3,(H,33,34)