2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-2-propan-2-yl-5-[(5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-3H-pyran-4-one

Systemtic Name: 2-[2-(4-hydroxyphenyl)ethyl]-6-oxidanyl-2-propan-2-yl-5-[(5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-3H-pyran-4-one Openeye Name: 6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-5-[(5-isopropyl-1,3-benzothiazol-6-yl)sulfanyl]-3H-pyran-4-one CAS Name: 6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-propan-2-yl-5-[(5-propan-2-yl-1,3-benzothiazol-6-yl)thio]-3H-pyran-4-one IUPAC Name: 6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-propan-2-yl-5-[(5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-3H-pyran-4-one Traditional Name: 6-hydroxy-2-[2-(4-hydroxyphenyl)ethyl]-2-isopropyl-5-[(5-isopropyl-1,3-benzothiazol-6-yl)thio]-3H-pyran-4-one Formula: C26H29NO4S2 MolecularWeight: 483.64276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1SC3=C(OC(CC3=O)(CCC4=CC=C(C=C4)O)C(C)C)O)SC=N2

Isomeric SMILES

CC(C)C1=CC2=C(C=C1SC3=C(OC(CC3=O)(CCC4=CC=C(C=C4)O)C(C)C)O)SC=N2

InChI

InChI=1S/C26H29NO4S2/c1-15(2)19-11-20-23(32-14-27-20)12-22(19)33-24-21(29)13-26(16(3)4,31-25(24)30)10-9-17-5-7-18(28)8-6-17/h5-8,11-12,14-16,28,30H,9-10,13H2,1-4H3