N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-[(E)-(4-methylsulfanylphenyl)methyleneamino]-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-[(E)-[4-(methylthio)phenyl]methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-[(E)-(4-methylsulfanylphenyl)methylideneamino]-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-[(E)-[4-(methylthio)benzylidene]amino]-3H-phthalazine-1-carboxamide Formula: C17H14N4O2S MolecularWeight: 338.38366

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=NNC(=O)C2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CSC1=CC=C(C=C1)/C=N/NC(=O)C2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C17H14N4O2S/c1-24-12-8-6-11(7-9-12)10-18-20-17(23)15-13-4-2-3-5-14(13)16(22)21-19-15/h2-10H,1H3,(H,20,23)(H,21,22)/b18-10+