methyl 2-[[4-[(1-butan-2-yloxy-3-cyclohexyl-propan-2-yl)oxymethyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl 2-[[4-[(1-butan-2-yloxy-3-cyclohexyl-propan-2-yl)oxymethyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl 2-[[4-[[1-(cyclohexylmethyl)-2-sec-butoxy-ethoxy]methyl]-2-(o-tolyl)benzoyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[4-[(1-butan-2-yloxy-3-cyclohexylpropan-2-yl)oxymethyl]-2-(2-methylphenyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-[[4-[(1-butan-2-yloxy-3-cyclohexylpropan-2-yl)oxymethyl]-2-(2-methylphenyl)benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[4-[[1-(cyclohexylmethyl)-2-sec-butoxy-ethoxy]methyl]-2-(o-tolyl)benzoyl]amino]-4-(methylthio)butyric acid methyl ester Formula: C34H49NO5S MolecularWeight: 583.82156

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OCC(CC1CCCCC1)OCC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)OC)C3=CC=CC=C3C

Isomeric SMILES

CCC(C)OCC(CC1CCCCC1)OCC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)OC)C3=CC=CC=C3C

InChI

InChI=1S/C34H49NO5S/c1-6-25(3)39-23-28(20-26-13-8-7-9-14-26)40-22-27-16-17-30(31(21-27)29-15-11-10-12-24(29)2)33(36)35-32(18-19-41-5)34(37)38-4/h10-12,15-17,21,25-26,28,32H,6-9,13-14,18-20,22-23H2,1-5H3,(H,35,36)