[5-tert-butyl-4-[[2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-4-oxidanylidene-2-propan-2-yl-3H-pyran-5-yl]sulfanyl]-2-methyl-phenyl] N-propylsulfamate

Systemtic Name: [5-tert-butyl-4-[[2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-4-oxidanylidene-2-propan-2-yl-3H-pyran-5-yl]sulfanyl]-2-methyl-phenyl] N-propylsulfamate Openeye Name: [5-tert-butyl-4-[[6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-4-oxo-3H-pyran-5-yl]sulfanyl]-2-methyl-phenyl] N-propylsulfamate CAS Name: N-propylsulfamic acid [5-tert-butyl-4-[[6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-oxo-2-propan-2-yl-3H-pyran-5-yl]thio]-2-methylphenyl] ester IUPAC Name: [5-tert-butyl-4-[[6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-4-oxo-2-propan-2-yl-3H-pyran-5-yl]sulfanyl]-2-methylphenyl] N-propylsulfamate Traditional Name: N-propylsulfamic acid [5-tert-butyl-4-[[6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-4-keto-3H-pyran-5-yl]thio]-2-methyl-phenyl] ester Formula: C30H41NO7S2 MolecularWeight: 591.77904

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)OC1=C(C=C(C(=C1)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CC=C(C=C3)O)C(C)C)O)C

Isomeric SMILES

CCCNS(=O)(=O)OC1=C(C=C(C(=C1)C(C)(C)C)SC2=C(OC(CC2=O)(CCC3=CC=C(C=C3)O)C(C)C)O)C

InChI

InChI=1S/C30H41NO7S2/c1-8-15-31-40(35,36)38-25-17-23(29(5,6)7)26(16-20(25)4)39-27-24(33)18-30(19(2)3,37-28(27)34)14-13-21-9-11-22(32)12-10-21/h9-12,16-17,19,31-32,34H,8,13-15,18H2,1-7H3