(E)-3-[1-(4-methylsulfanylphenyl)-1H-phthalazin-2-yl]prop-2-enal

Systemtic Name: (E)-3-[1-(4-methylsulfanylphenyl)-1H-phthalazin-2-yl]prop-2-enal Openeye Name: (E)-3-[1-(4-methylsulfanylphenyl)-1H-phthalazin-2-yl]prop-2-enal CAS Name: (E)-3-[1-[4-(methylthio)phenyl]-1H-phthalazin-2-yl]-2-propenal IUPAC Name: (E)-3-[1-(4-methylsulfanylphenyl)-1H-phthalazin-2-yl]prop-2-enal Traditional Name: (E)-3-[1-[4-(methylthio)phenyl]-1H-phthalazin-2-yl]acrolein Formula: C18H16N2OS MolecularWeight: 308.39744

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2C3=CC=CC=C3C=NN2C=CC=O

Isomeric SMILES

CSC1=CC=C(C=C1)C2C3=CC=CC=C3C=NN2/C=C/C=O

InChI

InChI=1S/C18H16N2OS/c1-22-16-9-7-14(8-10-16)18-17-6-3-2-5-15(17)13-19-20(18)11-4-12-21/h2-13,18H,1H3/b11-4+