S-(6-methoxy-4-methyl-quinazolin-2-yl) ethanethioate

Systemtic Name: S-(6-methoxy-4-methyl-quinazolin-2-yl) ethanethioate Openeye Name: S-(6-methoxy-4-methyl-quinazolin-2-yl) ethanethioate CAS Name: ethanethioic acid S-(6-methoxy-4-methyl-2-quinazolinyl) ester IUPAC Name: S-(6-methoxy-4-methylquinazolin-2-yl) ethanethioate Traditional Name: ethanethioic acid S-(6-methoxy-4-methyl-quinazolin-2-yl) ester Formula: C12H12N2O2S MolecularWeight: 248.30088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O2S/c1-7-10-6-9(16-3)4-5-11(10)14-12(13-7)17-8(2)15/h4-6H,1-3H3