ethyl 2-[1-methyl-5-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)pyrazol-4-yl]ethanoate

Systemtic Name: ethyl 2-[1-methyl-5-(4-oxidanylidene-2-phenyl-quinazolin-3-yl)pyrazol-4-yl]ethanoate Openeye Name: ethyl 2-[1-methyl-5-(4-oxo-2-phenyl-quinazolin-3-yl)pyrazol-4-yl]acetate CAS Name: 2-[1-methyl-5-(4-oxo-2-phenyl-3-quinazolinyl)-4-pyrazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[1-methyl-5-(4-oxo-2-phenylquinazolin-3-yl)pyrazol-4-yl]acetate Traditional Name: 2-[5-(4-keto-2-phenyl-quinazolin-3-yl)-1-methyl-pyrazol-4-yl]acetic acid ethyl ester Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N(N=C1)C)N2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CC1=C(N(N=C1)C)N2C(=NC3=CC=CC=C3C2=O)C4=CC=CC=C4

InChI

InChI=1S/C22H20N4O3/c1-3-29-19(27)13-16-14-23-25(2)21(16)26-20(15-9-5-4-6-10-15)24-18-12-8-7-11-17(18)22(26)28/h4-12,14H,3,13H2,1-2H3