(2R)-2-[(6-methoxyquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2R)-2-[(6-methoxyquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: (2R)-2-[(6-methoxyquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid CAS Name: (2R)-2-[(6-methoxy-4-quinazolinyl)amino]-4-(methylthio)butanoic acid IUPAC Name: (2R)-2-[(6-methoxyquinazolin-4-yl)amino]-4-methylsulfanylbutanoic acid Traditional Name: (2R)-2-[(6-methoxyquinazolin-4-yl)amino]-4-(methylthio)butyric acid Formula: C14H17N3O3S MolecularWeight: 307.36808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=CN=C2NC(CCSC)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N=CN=C2N[C@H](CCSC)C(=O)O

InChI

InChI=1S/C14H17N3O3S/c1-20-9-3-4-11-10(7-9)13(16-8-15-11)17-12(14(18)19)5-6-21-2/h3-4,7-8,12H,5-6H2,1-2H3,(H,18,19)(H,15,16,17)/t12-/m1/s1