2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-prop-2-ynyl-ethanamide

Systemtic Name: 2-[6-bromanyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-prop-2-ynyl-ethanamide Openeye Name: 2-[6-bromo-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-prop-2-ynyl-acetamide CAS Name: 2-[[6-bromo-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-prop-2-ynylacetamide IUPAC Name: 2-[6-bromo-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-prop-2-ynylacetamide Traditional Name: 2-[[6-bromo-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-propargyl-acetamide Formula: C16H16BrN3O3S MolecularWeight: 410.28554

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCC#C

Isomeric SMILES

COCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCC#C

InChI

InChI=1S/C16H16BrN3O3S/c1-3-6-18-14(21)10-24-16-19-13-5-4-11(17)9-12(13)15(22)20(16)7-8-23-2/h1,4-5,9H,6-8,10H2,2H3,(H,18,21)