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

Systemtic Name: ethyl 3-(4,6,7-trimethylquinazolin-2-yl)sulfanylpropanoate Openeye Name: ethyl 3-(4,6,7-trimethylquinazolin-2-yl)sulfanylpropanoate CAS Name: 3-[(4,6,7-trimethyl-2-quinazolinyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4,6,7-trimethylquinazolin-2-yl)sulfanylpropanoate Traditional Name: 3-[(4,6,7-trimethylquinazolin-2-yl)thio]propionic acid ethyl ester Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC2=CC(=C(C=C2C(=N1)C)C)C

Isomeric SMILES

CCOC(=O)CCSC1=NC2=CC(=C(C=C2C(=N1)C)C)C

InChI

InChI=1S/C16H20N2O2S/c1-5-20-15(19)6-7-21-16-17-12(4)13-8-10(2)11(3)9-14(13)18-16/h8-9H,5-7H2,1-4H3