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

Systemtic Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-[2-(p-tolylsulfanyl)ethyl]-3H-phthalazine-1-carboxamide CAS Name: N-[2-[(4-methylphenyl)thio]ethyl]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylethyl]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[2-(p-tolylthio)ethyl]-3H-phthalazine-1-carboxamide Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17N3O2S/c1-12-6-8-13(9-7-12)24-11-10-19-18(23)16-14-4-2-3-5-15(14)17(22)21-20-16/h2-9H,10-11H2,1H3,(H,19,23)(H,21,22)