ethyl 4-[[3-[(3-chlorophenyl)methyl]-2-methyl-4-oxidanylidene-quinazolin-6-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[[3-[(3-chlorophenyl)methyl]-2-methyl-4-oxidanylidene-quinazolin-6-yl]amino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[[3-[(3-chlorophenyl)methyl]-2-methyl-4-oxo-quinazolin-6-yl]amino]-4-oxo-butanoate CAS Name: 4-[[3-[(3-chlorophenyl)methyl]-2-methyl-4-oxo-6-quinazolinyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[[3-[(3-chlorophenyl)methyl]-2-methyl-4-oxoquinazolin-6-yl]amino]-4-oxobutanoate Traditional Name: 4-[[3-(3-chlorobenzyl)-4-keto-2-methyl-quinazolin-6-yl]amino]-4-keto-butyric acid ethyl ester Formula: C22H22ClN3O4 MolecularWeight: 427.88078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC1=CC2=C(C=C1)N=C(N(C2=O)CC3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCOC(=O)CCC(=O)NC1=CC2=C(C=C1)N=C(N(C2=O)CC3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C22H22ClN3O4/c1-3-30-21(28)10-9-20(27)25-17-7-8-19-18(12-17)22(29)26(14(2)24-19)13-15-5-4-6-16(23)11-15/h4-8,11-12H,3,9-10,13H2,1-2H3,(H,25,27)