cyclohexyl 2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: cyclohexyl 2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate Openeye Name: cyclohexyl 2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(3-methyl-4-oxo-2-quinazolinyl)thio]acetic acid cyclohexyl ester IUPAC Name: cyclohexyl 2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-3-methyl-quinazolin-2-yl)thio]acetic acid cyclohexyl ester Formula: C17H20N2O3S MolecularWeight: 332.4173

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)OC3CCCCC3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)OC3CCCCC3

InChI

InChI=1S/C17H20N2O3S/c1-19-16(21)13-9-5-6-10-14(13)18-17(19)23-11-15(20)22-12-7-3-2-4-8-12/h5-6,9-10,12H,2-4,7-8,11H2,1H3