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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-(4-oxidanylidene-1H-quinazolin-2-yl)propanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-(4-oxo-1H-quinazolin-2-yl)propanoate CAS Name: 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(4-oxo-1H-quinazolin-2-yl)propanoate Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)propionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H15N3O3S MolecularWeight: 365.4057

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CCC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H15N3O3S/c23-18(25-11-17-21-14-7-3-4-8-15(14)26-17)10-9-16-20-13-6-2-1-5-12(13)19(24)22-16/h1-8H,9-11H2,(H,20,22,24)