cyclopentane; 2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-6-[4-(pyridin-3-ylmethoxy)phenyl]pyran-4-one

Systemtic Name: cyclopentane; 2-oxidanyl-3-(2-propan-2-ylphenyl)sulfanyl-6-[4-(pyridin-3-ylmethoxy)phenyl]pyran-4-one Openeye Name: cyclopentane; 2-hydroxy-3-(2-isopropylphenyl)sulfanyl-6-[4-(3-pyridylmethoxy)phenyl]pyran-4-one CAS Name: cyclopentane; 2-hydroxy-3-[(2-propan-2-ylphenyl)thio]-6-[4-(3-pyridinylmethoxy)phenyl]-4-pyranone IUPAC Name: cyclopentane; 2-hydroxy-3-(2-propan-2-ylphenyl)sulfanyl-6-[4-(pyridin-3-ylmethoxy)phenyl]pyran-4-one Traditional Name: cyclopentane; 2-hydroxy-3-(o-cumenylthio)-6-[4-(3-pyridylmethoxy)phenyl]pyran-4-one Formula: C31H33NO4S MolecularWeight: 515.66302

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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)OCC4=CN=CC=C4)O.C1CCCC1

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=C(OC(=CC2=O)C3=CC=C(C=C3)OCC4=CN=CC=C4)O.C1CCCC1

InChI

InChI=1S/C26H23NO4S.C5H10/c1-17(2)21-7-3-4-8-24(21)32-25-22(28)14-23(31-26(25)29)19-9-11-20(12-10-19)30-16-18-6-5-13-27-15-18;1-2-4-5-3-1/h3-15,17,29H,16H2,1-2H3;1-5H2