3-(4-methoxyphenyl)-7-oxidanyl-2-(pyridin-4-ylmethylsulfanyl)chromen-4-one

Systemtic Name: 3-(4-methoxyphenyl)-7-oxidanyl-2-(pyridin-4-ylmethylsulfanyl)chromen-4-one Openeye Name: 7-hydroxy-3-(4-methoxyphenyl)-2-(4-pyridylmethylsulfanyl)chromen-4-one CAS Name: 7-hydroxy-3-(4-methoxyphenyl)-2-(pyridin-4-ylmethylthio)-1-benzopyran-4-one IUPAC Name: 7-hydroxy-3-(4-methoxyphenyl)-2-(pyridin-4-ylmethylsulfanyl)chromen-4-one Traditional Name: 7-hydroxy-3-(4-methoxyphenyl)-2-(4-pyridylmethylthio)chromone Formula: C22H17NO4S MolecularWeight: 391.43968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)O)SCC4=CC=NC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)O)SCC4=CC=NC=C4

InChI

InChI=1S/C22H17NO4S/c1-26-17-5-2-15(3-6-17)20-21(25)18-7-4-16(24)12-19(18)27-22(20)28-13-14-8-10-23-11-9-14/h2-12,24H,13H2,1H3