3-[2-tert-butyl-4-(thiomorpholin-4-ylmethyl)phenyl]sulfanyl-2-oxidanyl-6-phenyl-pyran-4-one

Systemtic Name: 3-[2-tert-butyl-4-(thiomorpholin-4-ylmethyl)phenyl]sulfanyl-2-oxidanyl-6-phenyl-pyran-4-one Openeye Name: 3-[2-tert-butyl-4-(thiomorpholinomethyl)phenyl]sulfanyl-2-hydroxy-6-phenyl-pyran-4-one CAS Name: 3-[[2-tert-butyl-4-(thiomorpholin-4-ylmethyl)phenyl]thio]-2-hydroxy-6-phenyl-4-pyranone IUPAC Name: 3-[2-tert-butyl-4-(thiomorpholin-4-ylmethyl)phenyl]sulfanyl-2-hydroxy-6-phenylpyran-4-one Traditional Name: 3-[[2-tert-butyl-4-(thiomorpholinomethyl)phenyl]thio]-2-hydroxy-6-phenyl-pyran-4-one Formula: C26H29NO3S2 MolecularWeight: 467.64336

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)CN2CCSCC2)SC3=C(OC(=CC3=O)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)CN2CCSCC2)SC3=C(OC(=CC3=O)C4=CC=CC=C4)O

InChI

InChI=1S/C26H29NO3S2/c1-26(2,3)20-15-18(17-27-11-13-31-14-12-27)9-10-23(20)32-24-21(28)16-22(30-25(24)29)19-7-5-4-6-8-19/h4-10,15-16,29H,11-14,17H2,1-3H3