2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-3-yl]ethanamide

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-3-yl]ethanamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[2-(3-methoxyphenyl)-4-oxo-quinazolin-3-yl]acetamide CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[2-(3-methoxyphenyl)-4-oxo-3-quinazolinyl]acetamide IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[2-(3-methoxyphenyl)-4-oxoquinazolin-3-yl]acetamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[4-keto-2-(3-methoxyphenyl)quinazolin-3-yl]acetamide Formula: C22H20N6O5 MolecularWeight: 448.4314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NN2C(=NC3=CC=CC=C3C2=O)C4=CC(=CC=C4)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NN2C(=NC3=CC=CC=C3C2=O)C4=CC(=CC=C4)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C22H20N6O5/c1-13-20(28(31)32)14(2)26(24-13)12-19(29)25-27-21(15-7-6-8-16(11-15)33-3)23-18-10-5-4-9-17(18)22(27)30/h4-11H,12H2,1-3H3,(H,25,29)