N-(2-chloranyl-5-methylsulfonyl-phenyl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-(2-chloranyl-5-methylsulfonyl-phenyl)-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-(2-chloro-5-methylsulfonyl-phenyl)-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-(2-chloro-5-methylsulfonylphenyl)-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-(2-chloro-5-methylsulfonylphenyl)-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-(2-chloro-5-mesyl-phenyl)-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C22H16ClN3O4S MolecularWeight: 453.89814

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)Cl)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C22H16ClN3O4S/c1-31(29,30)15-11-12-18(23)19(13-15)24-21(27)20-16-9-5-6-10-17(16)22(28)26(25-20)14-7-3-2-4-8-14/h2-13H,1H3,(H,24,27)