2-tert-butylsulfanyl-8-(1-methyl-3-oxidanyl-piperidin-4-yl)-5,7-bis(oxidanyl)chromen-4-one

Systemtic Name: 2-tert-butylsulfanyl-8-(1-methyl-3-oxidanyl-piperidin-4-yl)-5,7-bis(oxidanyl)chromen-4-one Openeye Name: 2-tert-butylsulfanyl-5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidyl)chromen-4-one CAS Name: 2-(tert-butylthio)-5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidinyl)-1-benzopyran-4-one IUPAC Name: 2-tert-butylsulfanyl-5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)chromen-4-one Traditional Name: 2-(tert-butylthio)-5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidyl)chromone Formula: C19H25NO5S MolecularWeight: 379.4705

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC1=CC(=O)C2=C(O1)C(=C(C=C2O)O)C3CCN(CC3O)C

Isomeric SMILES

CC(C)(C)SC1=CC(=O)C2=C(O1)C(=C(C=C2O)O)C3CCN(CC3O)C

InChI

InChI=1S/C19H25NO5S/c1-19(2,3)26-15-8-13(23)17-12(22)7-11(21)16(18(17)25-15)10-5-6-20(4)9-14(10)24/h7-8,10,14,21-22,24H,5-6,9H2,1-4H3