ethyl 2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC(C)C

Isomeric SMILES

CCOC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC(C)C

InChI

InChI=1S/C16H20N2O3S/c1-4-21-14(19)10-22-16-17-13-8-6-5-7-12(13)15(20)18(16)9-11(2)3/h5-8,11H,4,9-10H2,1-3H3