methyl 2-[(3-methyl-5-nitro-imidazol-4-yl)-(6-methyl-4-phenyl-quinazolin-2-yl)amino]ethanoate

Systemtic Name: methyl 2-[(3-methyl-5-nitro-imidazol-4-yl)-(6-methyl-4-phenyl-quinazolin-2-yl)amino]ethanoate Openeye Name: methyl 2-[(3-methyl-5-nitro-imidazol-4-yl)-(6-methyl-4-phenyl-quinazolin-2-yl)amino]acetate CAS Name: 2-[(3-methyl-5-nitro-4-imidazolyl)-(6-methyl-4-phenyl-2-quinazolinyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[(3-methyl-5-nitroimidazol-4-yl)-(6-methyl-4-phenylquinazolin-2-yl)amino]acetate Traditional Name: 2-[(3-methyl-5-nitro-imidazol-4-yl)-(6-methyl-4-phenyl-quinazolin-2-yl)amino]acetic acid methyl ester Formula: C22H20N6O4 MolecularWeight: 432.432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N(CC(=O)OC)C4=C(N=CN4C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N=C2C3=CC=CC=C3)N(CC(=O)OC)C4=C(N=CN4C)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O4/c1-14-9-10-17-16(11-14)19(15-7-5-4-6-8-15)25-22(24-17)27(12-18(29)32-3)21-20(28(30)31)23-13-26(21)2/h4-11,13H,12H2,1-3H3