5-[2-(4-phenylphthalazin-1-yl)sulfanylethanoylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[2-(4-phenylphthalazin-1-yl)sulfanylethanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[2-[(4-phenylphthalazin-1-yl)thio]acetyl]amino]isophthalamide Formula: C24H19N5O3S MolecularWeight: 457.50436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N

InChI

InChI=1S/C24H19N5O3S/c25-22(31)15-10-16(23(26)32)12-17(11-15)27-20(30)13-33-24-19-9-5-4-8-18(19)21(28-29-24)14-6-2-1-3-7-14/h1-12H,13H2,(H2,25,31)(H2,26,32)(H,27,30)