3-[1-(2-chloranyl-4-methyl-phenyl)phthalazin-6-yl]-N-cyclopropyl-4-methyl-benzamide

Systemtic Name: 3-[1-(2-chloranyl-4-methyl-phenyl)phthalazin-6-yl]-N-cyclopropyl-4-methyl-benzamide Openeye Name: 3-[1-(2-chloro-4-methyl-phenyl)phthalazin-6-yl]-N-cyclopropyl-4-methyl-benzamide CAS Name: 3-[1-(2-chloro-4-methylphenyl)-6-phthalazinyl]-N-cyclopropyl-4-methylbenzamide IUPAC Name: 3-[1-(2-chloro-4-methylphenyl)phthalazin-6-yl]-N-cyclopropyl-4-methylbenzamide Traditional Name: 3-[1-(2-chloro-4-methyl-phenyl)phthalazin-6-yl]-N-cyclopropyl-4-methyl-benzamide Formula: C26H22ClN3O MolecularWeight: 427.92538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=C3C=CC(=CC3=CN=N2)C4=C(C=CC(=C4)C(=O)NC5CC5)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C2=C3C=CC(=CC3=CN=N2)C4=C(C=CC(=C4)C(=O)NC5CC5)C)Cl

InChI

InChI=1S/C26H22ClN3O/c1-15-3-9-22(24(27)11-15)25-21-10-6-17(12-19(21)14-28-30-25)23-13-18(5-4-16(23)2)26(31)29-20-7-8-20/h3-6,9-14,20H,7-8H2,1-2H3,(H,29,31)