N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl-ethanamide Openeye Name: N-(2,4-dichlorophenyl)-2-[4-(p-tolyl)phthalazin-1-yl]sulfanyl-acetamide CAS Name: N-(2,4-dichlorophenyl)-2-[[4-(4-methylphenyl)-1-phthalazinyl]thio]acetamide IUPAC Name: N-(2,4-dichlorophenyl)-2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanylacetamide Traditional Name: N-(2,4-dichlorophenyl)-2-[[4-(p-tolyl)phthalazin-1-yl]thio]acetamide Formula: C23H17Cl2N3OS MolecularWeight: 454.37158

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)NC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C23H17Cl2N3OS/c1-14-6-8-15(9-7-14)22-17-4-2-3-5-18(17)23(28-27-22)30-13-21(29)26-20-11-10-16(24)12-19(20)25/h2-12H,13H2,1H3,(H,26,29)