N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide

Systemtic Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide Openeye Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide IUPAC Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-[4-(2,5-dimethylpyrrol-1-yl)phenyl]-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C2=CC=C(C=C2)NC(=O)CC3=NN(C(=O)C4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC=C(N1C2=CC=C(C=C2)NC(=O)CC3=NN(C(=O)C4=CC=CC=C43)C)C

InChI

InChI=1S/C23H22N4O2/c1-15-8-9-16(2)27(15)18-12-10-17(11-13-18)24-22(28)14-21-19-6-4-5-7-20(19)23(29)26(3)25-21/h4-13H,14H2,1-3H3,(H,24,28)