(2R)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoic acid

Systemtic Name: (2R)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylpropanoic acid Openeye Name: (2R)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanylpropanoic acid CAS Name: (2R)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanoic acid IUPAC Name: (2R)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanoic acid Traditional Name: (2R)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionic acid Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

C[C@H](C(=O)O)SC1=NC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C12H12N2O3S/c1-7(11(16)17)18-12-13-9-6-4-3-5-8(9)10(15)14(12)2/h3-7H,1-2H3,(H,16,17)/t7-/m1/s1