2-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanamide

Systemtic Name: 2-[6,8-bis(chloranyl)-4-oxidanylidene-quinazolin-3-yl]-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanamide Openeye Name: 2-(6,8-dichloro-4-oxo-quinazolin-3-yl)-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetamide CAS Name: 2-(6,8-dichloro-4-oxo-3-quinazolinyl)-N-(3,5-dimethyl-1-phenyl-4-pyrazolyl)acetamide IUPAC Name: 2-(6,8-dichloro-4-oxoquinazolin-3-yl)-N-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetamide Traditional Name: 2-(6,8-dichloro-4-keto-quinazolin-3-yl)-N-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetamide Formula: C21H17Cl2N5O2 MolecularWeight: 442.29798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CN3C=NC4=C(C=C(C=C4C3=O)Cl)Cl

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)NC(=O)CN3C=NC4=C(C=C(C=C4C3=O)Cl)Cl

InChI

InChI=1S/C21H17Cl2N5O2/c1-12-19(13(2)28(26-12)15-6-4-3-5-7-15)25-18(29)10-27-11-24-20-16(21(27)30)8-14(22)9-17(20)23/h3-9,11H,10H2,1-2H3,(H,25,29)