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

Systemtic Name: 7-oxidanyl-3-phenyl-2-(pyridin-4-ylmethylsulfanyl)chromen-4-one Openeye Name: 7-hydroxy-3-phenyl-2-(4-pyridylmethylsulfanyl)chromen-4-one CAS Name: 7-hydroxy-3-phenyl-2-(pyridin-4-ylmethylthio)-1-benzopyran-4-one IUPAC Name: 7-hydroxy-3-phenyl-2-(pyridin-4-ylmethylsulfanyl)chromen-4-one Traditional Name: 7-hydroxy-3-phenyl-2-(4-pyridylmethylthio)chromone Formula: C21H15NO3S MolecularWeight: 361.4137

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15NO3S/c23-16-6-7-17-18(12-16)25-21(26-13-14-8-10-22-11-9-14)19(20(17)24)15-4-2-1-3-5-15/h1-12,23H,13H2