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

Systemtic Name: N-[4-[(3-chloranyl-4-methoxy-phenyl)methylamino]-6-cyano-phthalazin-1-yl]benzamide Openeye Name: N-[4-[(3-chloro-4-methoxy-phenyl)methylamino]-6-cyano-phthalazin-1-yl]benzamide CAS Name: N-[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyano-1-phthalazinyl]benzamide IUPAC Name: N-[4-[(3-chloro-4-methoxyphenyl)methylamino]-6-cyanophthalazin-1-yl]benzamide Traditional Name: N-[4-[(3-chloro-4-methoxy-benzyl)amino]-6-cyano-phthalazin-1-yl]benzamide Formula: C24H18ClN5O2 MolecularWeight: 443.88502

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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)NC(=O)C4=CC=CC=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C24H18ClN5O2/c1-32-21-10-8-16(12-20(21)25)14-27-22-19-11-15(13-26)7-9-18(19)23(30-29-22)28-24(31)17-5-3-2-4-6-17/h2-12H,14H2,1H3,(H,27,29)(H,28,30,31)