5-[4-[(3-chlorophenyl)amino]phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide

Systemtic Name: 5-[4-[(3-chlorophenyl)amino]phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide Openeye Name: 5-[4-(3-chloroanilino)phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide CAS Name: 5-[4-(3-chloroanilino)-1-phthalazinyl]-N,2-dimethylbenzenesulfonamide IUPAC Name: 5-[4-(3-chloroanilino)phthalazin-1-yl]-N,2-dimethylbenzenesulfonamide Traditional Name: 5-[4-(3-chloroanilino)phthalazin-1-yl]-N,2-dimethyl-benzenesulfonamide Formula: C22H19ClN4O2S MolecularWeight: 438.92986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN4O2S/c1-14-10-11-15(12-20(14)30(28,29)24-2)21-18-8-3-4-9-19(18)22(27-26-21)25-17-7-5-6-16(23)13-17/h3-13,24H,1-2H3,(H,25,27)