(4-azanylquinazolin-2-yl)methyl 1,3-benzothiazole-6-carboxylate

Systemtic Name: (4-azanylquinazolin-2-yl)methyl 1,3-benzothiazole-6-carboxylate Openeye Name: (4-aminoquinazolin-2-yl)methyl 1,3-benzothiazole-6-carboxylate CAS Name: 1,3-benzothiazole-6-carboxylic acid (4-amino-2-quinazolinyl)methyl ester IUPAC Name: (4-aminoquinazolin-2-yl)methyl 1,3-benzothiazole-6-carboxylate Traditional Name: 1,3-benzothiazole-6-carboxylic acid (4-aminoquinazolin-2-yl)methyl ester Formula: C17H12N4O2S MolecularWeight: 336.36778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC4=C(C=C3)N=CS4)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)COC(=O)C3=CC4=C(C=C3)N=CS4)N

InChI

InChI=1S/C17H12N4O2S/c18-16-11-3-1-2-4-12(11)20-15(21-16)8-23-17(22)10-5-6-13-14(7-10)24-9-19-13/h1-7,9H,8H2,(H2,18,20,21)