propan-2-yl 2-[2-(3,4-dimethoxyphenyl)sulfanylethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: propan-2-yl 2-[2-(3,4-dimethoxyphenyl)sulfanylethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: isopropyl 2-[[2-(3,4-dimethoxyphenyl)sulfanylacetyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[2-[(3,4-dimethoxyphenyl)thio]-1-oxoethyl]amino]-4-(methylthio)butanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[2-(3,4-dimethoxyphenyl)sulfanylacetyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-[(3,4-dimethoxyphenyl)thio]acetyl]amino]-4-(methylthio)butyric acid isopropyl ester Formula: C18H27NO5S2 MolecularWeight: 401.54068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(CCSC)NC(=O)CSC1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CC(C)OC(=O)C(CCSC)NC(=O)CSC1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C18H27NO5S2/c1-12(2)24-18(21)14(8-9-25-5)19-17(20)11-26-13-6-7-15(22-3)16(10-13)23-4/h6-7,10,12,14H,8-9,11H2,1-5H3,(H,19,20)