2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanylethanamide

Systemtic Name: 2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanylethanamide Openeye Name: 2-[4-(p-tolyl)phthalazin-1-yl]sulfanylacetamide CAS Name: 2-[[4-(4-methylphenyl)-1-phthalazinyl]thio]acetamide IUPAC Name: 2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanylacetamide Traditional Name: 2-[[4-(p-tolyl)phthalazin-1-yl]thio]acetamide Formula: C17H15N3OS MolecularWeight: 309.3855

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)N

InChI

InChI=1S/C17H15N3OS/c1-11-6-8-12(9-7-11)16-13-4-2-3-5-14(13)17(20-19-16)22-10-15(18)21/h2-9H,10H2,1H3,(H2,18,21)