2-(6-methoxy-4-methyl-quinazolin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(6-methoxy-4-methyl-quinazolin-2-yl)sulfanylethanoic acid Openeye Name: 2-(6-methoxy-4-methyl-quinazolin-2-yl)sulfanylacetic acid CAS Name: 2-[(6-methoxy-4-methyl-2-quinazolinyl)thio]acetic acid IUPAC Name: 2-(6-methoxy-4-methylquinazolin-2-yl)sulfanylacetic acid Traditional Name: 2-[(6-methoxy-4-methyl-quinazolin-2-yl)thio]acetic acid Formula: C12H12N2O3S MolecularWeight: 264.30028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)OC)SCC(=O)O

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)OC)SCC(=O)O

InChI

InChI=1S/C12H12N2O3S/c1-7-9-5-8(17-2)3-4-10(9)14-12(13-7)18-6-11(15)16/h3-5H,6H2,1-2H3,(H,15,16)