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

Systemtic Name: 3-(4-methoxyphenyl)-7-phenylmethoxy-2-(pyridin-4-ylmethylsulfanyl)chromen-4-one Openeye Name: 7-benzyloxy-3-(4-methoxyphenyl)-2-(4-pyridylmethylsulfanyl)chromen-4-one CAS Name: 3-(4-methoxyphenyl)-7-phenylmethoxy-2-(pyridin-4-ylmethylthio)-1-benzopyran-4-one IUPAC Name: 3-(4-methoxyphenyl)-7-phenylmethoxy-2-(pyridin-4-ylmethylsulfanyl)chromen-4-one Traditional Name: 7-benzoxy-3-(4-methoxyphenyl)-2-(4-pyridylmethylthio)chromone Formula: C29H23NO4S MolecularWeight: 481.56222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=CC=C4)SCC5=CC=NC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=C(OC3=C(C2=O)C=CC(=C3)OCC4=CC=CC=C4)SCC5=CC=NC=C5

InChI

InChI=1S/C29H23NO4S/c1-32-23-9-7-22(8-10-23)27-28(31)25-12-11-24(33-18-20-5-3-2-4-6-20)17-26(25)34-29(27)35-19-21-13-15-30-16-14-21/h2-17H,18-19H2,1H3