N-[5-(4-chlorophenyl)benzimidazolo[2,1-a]phthalazin-9-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[5-(4-chlorophenyl)benzimidazolo[2,1-a]phthalazin-9-yl]-2,2-dimethyl-propanamide Openeye Name: N-[5-(4-chlorophenyl)benzimidazolo[2,1-a]phthalazin-9-yl]-2,2-dimethyl-propanamide CAS Name: N-[5-(4-chlorophenyl)-9-benzimidazolo[2,1-a]phthalazinyl]-2,2-dimethylpropanamide IUPAC Name: N-[5-(4-chlorophenyl)benzimidazolo[2,1-a]phthalazin-9-yl]-2,2-dimethylpropanamide Traditional Name: N-[5-(4-chlorophenyl)benzimidazolo[2,1-a]phthalazin-9-yl]-2,2-dimethyl-propionamide Formula: C25H21ClN4O MolecularWeight: 428.91344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC2=C(C=C1)N=C3N2N=C(C4=CC=CC=C43)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC2=C(C=C1)N=C3N2N=C(C4=CC=CC=C43)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H21ClN4O/c1-25(2,3)24(31)27-17-12-13-20-21(14-17)30-23(28-20)19-7-5-4-6-18(19)22(29-30)15-8-10-16(26)11-9-15/h4-14H,1-3H3,(H,27,31)