3-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-6-propan-2-yl-6-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]oxane-2,4-dione

Systemtic Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-6-propan-2-yl-6-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]oxane-2,4-dione Openeye Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methyl-phenyl]sulfanyl-6-isopropyl-6-[2-(2-isopropylthiazol-4-yl)ethyl]tetrahydropyran-2,4-dione CAS Name: 3-[[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]thio]-6-propan-2-yl-6-[2-(2-propan-2-yl-4-thiazolyl)ethyl]oxane-2,4-dione IUPAC Name: 3-[2-tert-butyl-4-(hydroxymethyl)-5-methylphenyl]sulfanyl-6-propan-2-yl-6-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]oxane-2,4-dione Traditional Name: 3-[(2-tert-butyl-5-methyl-4-methylol-phenyl)thio]-6-isopropyl-6-[2-(2-isopropylthiazol-4-yl)ethyl]tetrahydropyran-2,4-quinone Formula: C28H39NO4S2 MolecularWeight: 517.74356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1CO)C(C)(C)C)SC2C(=O)CC(OC2=O)(CCC3=CSC(=N3)C(C)C)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1CO)C(C)(C)C)SC2C(=O)CC(OC2=O)(CCC3=CSC(=N3)C(C)C)C(C)C

InChI

InChI=1S/C28H39NO4S2/c1-16(2)25-29-20(15-34-25)9-10-28(17(3)4)13-22(31)24(26(32)33-28)35-23-11-18(5)19(14-30)12-21(23)27(6,7)8/h11-12,15-17,24,30H,9-10,13-14H2,1-8H3