3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[2-(p-tolylsulfanyl)ethyl]phthalazine-1-carboxamide CAS Name: 3-methyl-N-[2-[(4-methylphenyl)thio]ethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[2-(p-tolylthio)ethyl]phthalazine-1-carboxamide Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C19H19N3O2S/c1-13-7-9-14(10-8-13)25-12-11-20-18(23)17-15-5-3-4-6-16(15)19(24)22(2)21-17/h3-10H,11-12H2,1-2H3,(H,20,23)