(2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: [2-(3-thienyl)thiazol-4-yl]methyl 3-(3-methyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)propanoic acid [2-(3-thiophenyl)-4-thiazolyl]methyl ester IUPAC Name: (2-thiophen-3-yl-1,3-thiazol-4-yl)methyl 3-(3-methyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-3-methyl-quinazolin-2-yl)propionic acid [2-(3-thienyl)thiazol-4-yl]methyl ester Formula: C20H17N3O3S2 MolecularWeight: 411.49728

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)OCC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)OCC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C20H17N3O3S2/c1-23-17(22-16-5-3-2-4-15(16)20(23)25)6-7-18(24)26-10-14-12-28-19(21-14)13-8-9-27-11-13/h2-5,8-9,11-12H,6-7,10H2,1H3