2-oxidanyl-6-[4-(3-phenylpropoxy)phenyl]-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one

Systemtic Name: 2-oxidanyl-6-[4-(3-phenylpropoxy)phenyl]-3-(2-propan-2-ylphenyl)sulfanyl-pyran-4-one Openeye Name: 2-hydroxy-3-(2-isopropylphenyl)sulfanyl-6-[4-(3-phenylpropoxy)phenyl]pyran-4-one CAS Name: 2-hydroxy-6-[4-(3-phenylpropoxy)phenyl]-3-[(2-propan-2-ylphenyl)thio]-4-pyranone IUPAC Name: 2-hydroxy-6-[4-(3-phenylpropoxy)phenyl]-3-(2-propan-2-ylphenyl)sulfanylpyran-4-one Traditional Name: 2-hydroxy-3-(o-cumenylthio)-6-[4-(3-phenylpropoxy)phenyl]pyran-4-one Formula: C29H28O4S MolecularWeight: 472.59522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCCCC4=CC=CC=C4)O

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCCCC4=CC=CC=C4)O

InChI

InChI=1S/C29H28O4S/c1-20(2)24-12-6-7-13-27(24)34-28-25(30)19-26(33-29(28)31)22-14-16-23(17-15-22)32-18-8-11-21-9-4-3-5-10-21/h3-7,9-10,12-17,19-20,31H,8,11,18H2,1-2H3