(2R)-2-[(6-methoxy-2-methyl-4-oxidanylidene-quinazolin-3-yl)methylsulfanyl]propanoic acid

Systemtic Name: (2R)-2-[(6-methoxy-2-methyl-4-oxidanylidene-quinazolin-3-yl)methylsulfanyl]propanoic acid Openeye Name: (2R)-2-[(6-methoxy-2-methyl-4-oxo-quinazolin-3-yl)methylsulfanyl]propanoic acid CAS Name: (2R)-2-[(6-methoxy-2-methyl-4-oxo-3-quinazolinyl)methylthio]propanoic acid IUPAC Name: (2R)-2-[(6-methoxy-2-methyl-4-oxoquinazolin-3-yl)methylsulfanyl]propanoic acid Traditional Name: (2R)-2-[(4-keto-6-methoxy-2-methyl-quinazolin-3-yl)methylthio]propionic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OC)C(=O)N1CSC(C)C(=O)O

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OC)C(=O)N1CS[C@H](C)C(=O)O

InChI

InChI=1S/C14H16N2O4S/c1-8(14(18)19)21-7-16-9(2)15-12-5-4-10(20-3)6-11(12)13(16)17/h4-6,8H,7H2,1-3H3,(H,18,19)/t8-/m1/s1