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

Systemtic Name: N-(2,4-dimethoxyphenyl)-2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanyl-ethanamide Openeye Name: N-(2,4-dimethoxyphenyl)-2-[4-(p-tolyl)phthalazin-1-yl]sulfanyl-acetamide CAS Name: N-(2,4-dimethoxyphenyl)-2-[[4-(4-methylphenyl)-1-phthalazinyl]thio]acetamide IUPAC Name: N-(2,4-dimethoxyphenyl)-2-[4-(4-methylphenyl)phthalazin-1-yl]sulfanylacetamide Traditional Name: N-(2,4-dimethoxyphenyl)-2-[[4-(p-tolyl)phthalazin-1-yl]thio]acetamide Formula: C25H23N3O3S MolecularWeight: 445.53342

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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)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H23N3O3S/c1-16-8-10-17(11-9-16)24-19-6-4-5-7-20(19)25(28-27-24)32-15-23(29)26-21-13-12-18(30-2)14-22(21)31-3/h4-14H,15H2,1-3H3,(H,26,29)