3-methyl-4-oxidanylidene-N-(2-prop-2-enylsulfanylphenyl)phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-(2-prop-2-enylsulfanylphenyl)phthalazine-1-carboxamide Openeye Name: N-(2-allylsulfanylphenyl)-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[2-(prop-2-enylthio)phenyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-(2-prop-2-enylsulfanylphenyl)phthalazine-1-carboxamide Traditional Name: N-[2-(allylthio)phenyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3SCC=C

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=CC=C3SCC=C

InChI

InChI=1S/C19H17N3O2S/c1-3-12-25-16-11-7-6-10-15(16)20-18(23)17-13-8-4-5-9-14(13)19(24)22(2)21-17/h3-11H,1,12H2,2H3,(H,20,23)