4-[2-(4-phenylphthalazin-1-yl)sulfanylethanoylamino]benzamide

Systemtic Name: 4-[2-(4-phenylphthalazin-1-yl)sulfanylethanoylamino]benzamide Openeye Name: 4-[[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]benzamide CAS Name: 4-[[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]amino]benzamide IUPAC Name: 4-[[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]benzamide Traditional Name: 4-[[2-[(4-phenylphthalazin-1-yl)thio]acetyl]amino]benzamide Formula: C23H18N4O2S MolecularWeight: 414.47962

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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=C(C=C4)C(=O)N

Isomeric SMILES

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

InChI

InChI=1S/C23H18N4O2S/c24-22(29)16-10-12-17(13-11-16)25-20(28)14-30-23-19-9-5-4-8-18(19)21(26-27-23)15-6-2-1-3-7-15/h1-13H,14H2,(H2,24,29)(H,25,28)