propan-2-yl 2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-(6-bromo-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylacetate CAS Name: 2-[[6-bromo-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[6-bromo-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylacetate Traditional Name: 2-[(6-bromo-3-isobutyl-4-keto-quinazolin-2-yl)thio]acetic acid isopropyl ester Formula: C17H21BrN2O3S MolecularWeight: 413.32924

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)OC(C)C

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)OC(C)C

InChI

InChI=1S/C17H21BrN2O3S/c1-10(2)8-20-16(22)13-7-12(18)5-6-14(13)19-17(20)24-9-15(21)23-11(3)4/h5-7,10-11H,8-9H2,1-4H3