2-[2-(4-phenylphthalazin-1-yl)sulfanylethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-(4-phenylphthalazin-1-yl)sulfanylethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[(4-phenylphthalazin-1-yl)thio]acetyl]amino]thiophene-3-carboxamide Formula: C21H16N4O2S2 MolecularWeight: 420.50734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=CS4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=CS4)C(=O)N

InChI

InChI=1S/C21H16N4O2S2/c22-19(27)16-10-11-28-20(16)23-17(26)12-29-21-15-9-5-4-8-14(15)18(24-25-21)13-6-2-1-3-7-13/h1-11H,12H2,(H2,22,27)(H,23,26)