2-(6-methoxy-4-methyl-quinazolin-2-yl)sulfanylethyl benzoate

Systemtic Name: 2-(6-methoxy-4-methyl-quinazolin-2-yl)sulfanylethyl benzoate Openeye Name: 2-(6-methoxy-4-methyl-quinazolin-2-yl)sulfanylethyl benzoate CAS Name: benzoic acid 2-[(6-methoxy-4-methyl-2-quinazolinyl)thio]ethyl ester IUPAC Name: 2-(6-methoxy-4-methylquinazolin-2-yl)sulfanylethyl benzoate Traditional Name: benzoic acid 2-[(6-methoxy-4-methyl-quinazolin-2-yl)thio]ethyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=C2)OC)SCCOC(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=C2)OC)SCCOC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O3S/c1-13-16-12-15(23-2)8-9-17(16)21-19(20-13)25-11-10-24-18(22)14-6-4-3-5-7-14/h3-9,12H,10-11H2,1-2H3