N-[3-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-phthalazin-1-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-phthalazin-1-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-phthalazin-1-yl]phenyl]methanesulfonamide CAS Name: N-[3-[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-1-phthalazinyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyanophthalazin-1-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-phthalazin-1-yl]phenyl]methanesulfonamide Formula: C24H20ClN5O3S MolecularWeight: 493.9653

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=C(C=C3)C#N)C4=CC(=CC=C4)NS(=O)(=O)C)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=C(C=C3)C#N)C4=CC(=CC=C4)NS(=O)(=O)C)Cl

InChI

InChI=1S/C24H20ClN5O3S/c1-33-22-9-7-16(11-21(22)25)14-27-24-20-10-15(13-26)6-8-19(20)23(28-29-24)17-4-3-5-18(12-17)30-34(2,31)32/h3-12,30H,14H2,1-2H3,(H,27,29)