(2R)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2R)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid Openeye Name: (2R)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-4-methylsulfanyl-butanoic acid CAS Name: (2R)-2-[(6,7-dimethoxy-4-quinazolinyl)amino]-4-(methylthio)butanoic acid IUPAC Name: (2R)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-4-methylsulfanylbutanoic acid Traditional Name: (2R)-2-[(6,7-dimethoxyquinazolin-4-yl)amino]-4-(methylthio)butyric acid Formula: C15H19N3O4S MolecularWeight: 337.39406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=NC=N2)N[C@H](CCSC)C(=O)O)OC

InChI

InChI=1S/C15H19N3O4S/c1-21-12-6-9-11(7-13(12)22-2)16-8-17-14(9)18-10(15(19)20)4-5-23-3/h6-8,10H,4-5H2,1-3H3,(H,19,20)(H,16,17,18)/t10-/m1/s1