(4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate CAS Name: 4-(1,3-benzothiazol-2-yl)butanoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-(1,3-benzothiazol-2-yl)butanoate Traditional Name: 4-(1,3-benzothiazol-2-yl)butyric acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)COC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H17N3O3S/c24-19(11-5-10-18-22-15-8-3-4-9-16(15)27-18)26-12-17-21-14-7-2-1-6-13(14)20(25)23-17/h1-4,6-9H,5,10-12H2,(H,21,23,25)