1-azanyl-2,6-dimethyl-5-[[4-methyl-6-(4-methylsulfanylthian-4-yl)-5-oxidanylidene-hexyl]amino]-6-methylsulfanyl-heptan-4-one

Systemtic Name: 1-azanyl-2,6-dimethyl-5-[[4-methyl-6-(4-methylsulfanylthian-4-yl)-5-oxidanylidene-hexyl]amino]-6-methylsulfanyl-heptan-4-one Openeye Name: 1-amino-2,6-dimethyl-5-[[4-methyl-6-(4-methylsulfanyltetrahydrothiopyran-4-yl)-5-oxo-hexyl]amino]-6-methylsulfanyl-heptan-4-one CAS Name: 1-amino-2,6-dimethyl-5-[[4-methyl-6-[4-(methylthio)-4-thianyl]-5-oxohexyl]amino]-6-(methylthio)-4-heptanone IUPAC Name: 1-amino-2,6-dimethyl-5-[[4-methyl-6-(4-methylsulfanylthian-4-yl)-5-oxohexyl]amino]-6-methylsulfanylheptan-4-one Traditional Name: 1-amino-5-[[5-keto-4-methyl-6-[4-(methylthio)tetrahydrothiopyran-4-yl]hexyl]amino]-2,6-dimethyl-6-(methylthio)heptan-4-one Formula: C23H44N2O2S3 MolecularWeight: 476.80266

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H44N2O2S3/c1-17(16-24)14-19(26)21(22(3,4)28-5)25-11-7-8-18(2)20(27)15-23(29-6)9-12-30-13-10-23/h17-18,21,25H,7-16,24H2,1-6H3