N-[2-(1-methyl-5-nitro-benzimidazol-2-yl)ethyl]-2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)ethanamide

Systemtic Name: N-[2-(1-methyl-5-nitro-benzimidazol-2-yl)ethyl]-2-(4-methyl-1-oxidanylidene-phthalazin-2-yl)ethanamide Openeye Name: N-[2-(1-methyl-5-nitro-benzimidazol-2-yl)ethyl]-2-(4-methyl-1-oxo-phthalazin-2-yl)acetamide CAS Name: N-[2-(1-methyl-5-nitro-2-benzimidazolyl)ethyl]-2-(4-methyl-1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-[2-(1-methyl-5-nitrobenzimidazol-2-yl)ethyl]-2-(4-methyl-1-oxophthalazin-2-yl)acetamide Traditional Name: 2-(1-keto-4-methyl-phthalazin-2-yl)-N-[2-(1-methyl-5-nitro-benzimidazol-2-yl)ethyl]acetamide Formula: C21H20N6O4 MolecularWeight: 420.4213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NCCC3=NC4=C(N3C)C=CC(=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CC(=O)NCCC3=NC4=C(N3C)C=CC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O4/c1-13-15-5-3-4-6-16(15)21(29)26(24-13)12-20(28)22-10-9-19-23-17-11-14(27(30)31)7-8-18(17)25(19)2/h3-8,11H,9-10,12H2,1-2H3,(H,22,28)