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

Systemtic Name: (E)-1-cyclopropyl-3-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]prop-2-en-1-one Openeye Name: (E)-1-cyclopropyl-3-[4-methoxy-3-(2-pyridylsulfanylmethyl)phenyl]prop-2-en-1-one CAS Name: (E)-1-cyclopropyl-3-[4-methoxy-3-[(2-pyridinylthio)methyl]phenyl]-2-propen-1-one IUPAC Name: (E)-1-cyclopropyl-3-[4-methoxy-3-(pyridin-2-ylsulfanylmethyl)phenyl]prop-2-en-1-one Traditional Name: (E)-1-cyclopropyl-3-[4-methoxy-3-[(2-pyridylthio)methyl]phenyl]prop-2-en-1-one Formula: C19H19NO2S MolecularWeight: 325.42466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)C2CC2)CSC3=CC=CC=N3

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)C2CC2)CSC3=CC=CC=N3

InChI

InChI=1S/C19H19NO2S/c1-22-18-10-6-14(5-9-17(21)15-7-8-15)12-16(18)13-23-19-4-2-3-11-20-19/h2-6,9-12,15H,7-8,13H2,1H3/b9-5+