methyl 3-(4,6,7-trimethylquinazolin-2-yl)sulfanylpropanoate

Systemtic Name: methyl 3-(4,6,7-trimethylquinazolin-2-yl)sulfanylpropanoate Openeye Name: methyl 3-(4,6,7-trimethylquinazolin-2-yl)sulfanylpropanoate CAS Name: 3-[(4,6,7-trimethyl-2-quinazolinyl)thio]propanoic acid methyl ester IUPAC Name: methyl 3-(4,6,7-trimethylquinazolin-2-yl)sulfanylpropanoate Traditional Name: 3-[(4,6,7-trimethylquinazolin-2-yl)thio]propionic acid methyl ester Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=NC(=N2)SCCC(=O)OC)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=NC(=N2)SCCC(=O)OC)C)C

InChI

InChI=1S/C15H18N2O2S/c1-9-7-12-11(3)16-15(17-13(12)8-10(9)2)20-6-5-14(18)19-4/h7-8H,5-6H2,1-4H3