(E)-1-(3-methoxy-4-oxidanyl-phenyl)-3-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]prop-2-en-1-one

Systemtic Name: (E)-1-(3-methoxy-4-oxidanyl-phenyl)-3-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]prop-2-en-1-one Openeye Name: (E)-1-(4-hydroxy-3-methoxy-phenyl)-3-[4-methoxy-3-(2-pyridylsulfanylmethyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-(4-hydroxy-3-methoxyphenyl)-3-[4-methoxy-3-[(2-pyridinylthio)methyl]phenyl]-2-propen-1-one IUPAC Name: (E)-1-(4-hydroxy-3-methoxyphenyl)-3-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]prop-2-en-1-one Traditional Name: (E)-1-(4-hydroxy-3-methoxy-phenyl)-3-[4-methoxy-3-[(2-pyridylthio)methyl]phenyl]prop-2-en-1-one Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2=CC(=C(C=C2)O)OC)CSC3=CC=CC=N3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2=CC(=C(C=C2)O)OC)CSC3=CC=CC=N3

InChI

InChI=1S/C23H21NO4S/c1-27-21-11-7-16(13-18(21)15-29-23-5-3-4-12-24-23)6-9-19(25)17-8-10-20(26)22(14-17)28-2/h3-14,26H,15H2,1-2H3/b9-6+