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

Systemtic Name: (E)-3-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]-1-(4-methylphenyl)prop-2-en-1-one Openeye Name: (E)-3-[4-methoxy-3-(2-pyridylsulfanylmethyl)phenyl]-1-(p-tolyl)prop-2-en-1-one CAS Name: (E)-3-[4-methoxy-3-[(2-pyridinylthio)methyl]phenyl]-1-(4-methylphenyl)-2-propen-1-one IUPAC Name: (E)-3-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]-1-(4-methylphenyl)prop-2-en-1-one Traditional Name: (E)-3-[4-methoxy-3-[(2-pyridylthio)methyl]phenyl]-1-(p-tolyl)prop-2-en-1-one Formula: C23H21NO2S MolecularWeight: 375.48334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=CC2=CC(=C(C=C2)OC)CSC3=CC=CC=N3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C/C2=CC(=C(C=C2)OC)CSC3=CC=CC=N3

InChI

InChI=1S/C23H21NO2S/c1-17-6-10-19(11-7-17)21(25)12-8-18-9-13-22(26-2)20(15-18)16-27-23-5-3-4-14-24-23/h3-15H,16H2,1-2H3/b12-8+