methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]carbonylamino]-4-ethanoylsulfanyl-butanoate

Systemtic Name: methyl 2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]carbonylamino]-4-ethanoylsulfanyl-butanoate Openeye Name: methyl 4-acetylsulfanyl-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]butanoate CAS Name: 4-(acetylthio)-2-[[[2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]phenyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-acetylsulfanyl-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]butanoate Traditional Name: 4-(acetylthio)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]butyric acid methyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCC(C(=O)OC)NC(=O)C1=CC=CC=C1OC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CC(=O)SCCC(C(=O)OC)NC(=O)C1=CC=CC=C1OC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C20H23N3O7S/c1-12(24)31-10-9-14(19(26)29-4)21-18(25)13-7-5-6-8-15(13)30-20-22-16(27-2)11-17(23-20)28-3/h5-8,11,14H,9-10H2,1-4H3,(H,21,25)