N-(2,4-dichlorophenyl)-2-[1-methyl-5-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)methyl]pyrrol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(2,4-dichlorophenyl)-2-[1-methyl-5-[(3-methyl-4-oxidanylidene-phthalazin-1-yl)methyl]pyrrol-2-yl]sulfanyl-ethanamide Openeye Name: N-(2,4-dichlorophenyl)-2-[1-methyl-5-[(3-methyl-4-oxo-phthalazin-1-yl)methyl]pyrrol-2-yl]sulfanyl-acetamide CAS Name: N-(2,4-dichlorophenyl)-2-[[1-methyl-5-[(3-methyl-4-oxo-1-phthalazinyl)methyl]-2-pyrrolyl]thio]acetamide IUPAC Name: N-(2,4-dichlorophenyl)-2-[1-methyl-5-[(3-methyl-4-oxophthalazin-1-yl)methyl]pyrrol-2-yl]sulfanylacetamide Traditional Name: N-(2,4-dichlorophenyl)-2-[[5-[(4-keto-3-methyl-phthalazin-1-yl)methyl]-1-methyl-pyrrol-2-yl]thio]acetamide Formula: C23H20Cl2N4O2S MolecularWeight: 487.4015

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1SCC(=O)NC2=C(C=C(C=C2)Cl)Cl)CC3=NN(C(=O)C4=CC=CC=C43)C

Isomeric SMILES

CN1C(=CC=C1SCC(=O)NC2=C(C=C(C=C2)Cl)Cl)CC3=NN(C(=O)C4=CC=CC=C43)C

InChI

InChI=1S/C23H20Cl2N4O2S/c1-28-15(12-20-16-5-3-4-6-17(16)23(31)29(2)27-20)8-10-22(28)32-13-21(30)26-19-9-7-14(24)11-18(19)25/h3-11H,12-13H2,1-2H3,(H,26,30)