1,3-benzothiazol-2-ylmethyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-(3-methyl-4-oxidanylidene-quinazolin-2-yl)propanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-(3-methyl-4-oxo-quinazolin-2-yl)propanoate CAS Name: 3-(3-methyl-4-oxo-2-quinazolinyl)propanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(3-methyl-4-oxoquinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-3-methyl-quinazolin-2-yl)propionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CN1C(=NC2=CC=CC=C2C1=O)CCC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17N3O3S/c1-23-17(21-14-7-3-2-6-13(14)20(23)25)10-11-19(24)26-12-18-22-15-8-4-5-9-16(15)27-18/h2-9H,10-12H2,1H3