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

Systemtic Name: N-[2-(3-chlorophenyl)-4-oxidanylidene-quinazolin-3-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-[2-(3-chlorophenyl)-4-oxo-quinazolin-3-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-[2-(3-chlorophenyl)-4-oxo-3-quinazolinyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[2-(3-chlorophenyl)-4-oxoquinazolin-3-yl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetamide Traditional Name: N-[2-(3-chlorophenyl)-4-keto-quinazolin-3-yl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetamide Formula: C21H17ClN6O4 MolecularWeight: 452.85048

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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)Cl)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H17ClN6O4/c1-12-19(28(31)32)13(2)26(24-12)11-18(29)25-27-20(14-6-5-7-15(22)10-14)23-17-9-4-3-8-16(17)21(27)30/h3-10H,11H2,1-2H3,(H,25,29)