4-[(4-methylsulfanylphenyl)methyl]-2-prop-2-enyl-phthalazin-1-one

Systemtic Name: 4-[(4-methylsulfanylphenyl)methyl]-2-prop-2-enyl-phthalazin-1-one Openeye Name: 2-allyl-4-[(4-methylsulfanylphenyl)methyl]phthalazin-1-one CAS Name: 4-[[4-(methylthio)phenyl]methyl]-2-prop-2-enyl-1-phthalazinone IUPAC Name: 4-[(4-methylsulfanylphenyl)methyl]-2-prop-2-enylphthalazin-1-one Traditional Name: 2-allyl-4-[4-(methylthio)benzyl]phthalazin-1-one Formula: C19H18N2OS MolecularWeight: 322.42402

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)CC=C

Isomeric SMILES

CSC1=CC=C(C=C1)CC2=NN(C(=O)C3=CC=CC=C32)CC=C

InChI

InChI=1S/C19H18N2OS/c1-3-12-21-19(22)17-7-5-4-6-16(17)18(20-21)13-14-8-10-15(23-2)11-9-14/h3-11H,1,12-13H2,2H3