3-methyl-2-[[4-methyl-6-(4-methylsulfanylthian-4-yl)-5-oxidanylidene-hexyl]amino]-3-methylsulfanyl-butanoic acid

Systemtic Name: 3-methyl-2-[[4-methyl-6-(4-methylsulfanylthian-4-yl)-5-oxidanylidene-hexyl]amino]-3-methylsulfanyl-butanoic acid Openeye Name: 3-methyl-2-[[4-methyl-6-(4-methylsulfanyltetrahydrothiopyran-4-yl)-5-oxo-hexyl]amino]-3-methylsulfanyl-butanoic acid CAS Name: 3-methyl-2-[[4-methyl-6-[4-(methylthio)-4-thianyl]-5-oxohexyl]amino]-3-(methylthio)butanoic acid IUPAC Name: 3-methyl-2-[[4-methyl-6-(4-methylsulfanylthian-4-yl)-5-oxohexyl]amino]-3-methylsulfanylbutanoic acid Traditional Name: 2-[[5-keto-4-methyl-6-[4-(methylthio)tetrahydrothiopyran-4-yl]hexyl]amino]-3-methyl-3-(methylthio)butyric acid Formula: C19H35NO3S3 MolecularWeight: 421.6811

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCNC(C(=O)O)C(C)(C)SC)C(=O)CC1(CCSCC1)SC

Isomeric SMILES

CC(CCCNC(C(=O)O)C(C)(C)SC)C(=O)CC1(CCSCC1)SC

InChI

InChI=1S/C19H35NO3S3/c1-14(15(21)13-19(25-5)8-11-26-12-9-19)7-6-10-20-16(17(22)23)18(2,3)24-4/h14,16,20H,6-13H2,1-5H3,(H,22,23)