tert-butyl 2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate

Systemtic Name: tert-butyl 2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoate Openeye Name: tert-butyl 2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]acetic acid tert-butyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)OC(C)(C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)OC(C)(C)C

InChI

InChI=1S/C16H20N2O3S/c1-5-18-14(20)11-8-6-7-9-12(11)17-15(18)22-10-13(19)21-16(2,3)4/h6-9H,5,10H2,1-4H3