[(3-chloranyl-4-methoxy-phenyl)methylamino]-(2-cyanophenyl)-phthalazin-1-yl-methanesulfonamide hydrochloride

Systemtic Name: [(3-chloranyl-4-methoxy-phenyl)methylamino]-(2-cyanophenyl)-phthalazin-1-yl-methanesulfonamide hydrochloride Openeye Name: [(3-chloro-4-methoxy-phenyl)methylamino]-(2-cyanophenyl)-phthalazin-1-yl-methanesulfonamide hydrochloride CAS Name: [(3-chloro-4-methoxyphenyl)methylamino]-(2-cyanophenyl)-(1-phthalazinyl)methanesulfonamide hydrochloride IUPAC Name: [(3-chloro-4-methoxyphenyl)methylamino]-(2-cyanophenyl)-phthalazin-1-ylmethanesulfonamide hydrochloride Traditional Name: [(3-chloro-4-methoxy-benzyl)amino]-(2-cyanophenyl)-phthalazin-1-yl-methanesulfonamide hydrochloride Formula: C24H21Cl2N5O3S MolecularWeight: 530.42624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(C2=CC=CC=C2C#N)(C3=NN=CC4=CC=CC=C43)S(=O)(=O)N)Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(C2=CC=CC=C2C#N)(C3=NN=CC4=CC=CC=C43)S(=O)(=O)N)Cl.Cl

InChI

InChI=1S/C24H20ClN5O3S.ClH/c1-33-22-11-10-16(12-21(22)25)14-28-24(34(27,31)32,20-9-5-3-6-17(20)13-26)23-19-8-4-2-7-18(19)15-29-30-23;/h2-12,15,28H,14H2,1H3,(H2,27,31,32);1H