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

Systemtic Name: 3-(2-propan-2-ylphenyl)sulfanyl-6-[4-(pyridin-4-ylmethoxy)phenyl]pyran-2-one Openeye Name: 3-(2-isopropylphenyl)sulfanyl-6-[4-(4-pyridylmethoxy)phenyl]pyran-2-one CAS Name: 3-[(2-propan-2-ylphenyl)thio]-6-[4-(pyridin-4-ylmethoxy)phenyl]-2-pyranone IUPAC Name: 3-(2-propan-2-ylphenyl)sulfanyl-6-[4-(pyridin-4-ylmethoxy)phenyl]pyran-2-one Traditional Name: 3-(o-cumenylthio)-6-[4-(4-pyridylmethoxy)phenyl]pyran-2-one Formula: C26H23NO3S MolecularWeight: 429.53072

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=CC=C(OC2=O)C3=CC=C(C=C3)OCC4=CC=NC=C4

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=CC=C(OC2=O)C3=CC=C(C=C3)OCC4=CC=NC=C4

InChI

InChI=1S/C26H23NO3S/c1-18(2)22-5-3-4-6-24(22)31-25-12-11-23(30-26(25)28)20-7-9-21(10-8-20)29-17-19-13-15-27-16-14-19/h3-16,18H,17H2,1-2H3