2-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(2-chloranyl-6,7-dimethoxy-quinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[(2-chloro-6,7-dimethoxy-4-quinazolinyl)amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(2-chloro-6,7-dimethoxyquinazolin-4-yl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(2-chloro-6,7-dimethoxy-quinazolin-4-yl)amino]-4-(methylthio)butyric acid Formula: C15H18ClN3O4S MolecularWeight: 371.83912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NC(CCSC)C(=O)O)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC(=N2)Cl)NC(CCSC)C(=O)O)OC

InChI

InChI=1S/C15H18ClN3O4S/c1-22-11-6-8-10(7-12(11)23-2)18-15(16)19-13(8)17-9(14(20)21)4-5-24-3/h6-7,9H,4-5H2,1-3H3,(H,20,21)(H,17,18,19)