2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)ethyl]ethanamide Openeye Name: 2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)ethyl]acetamide CAS Name: 2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide IUPAC Name: 2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)ethyl]acetamide Traditional Name: 2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]-N-[2-(4-methoxyphenyl)ethyl]acetamide Formula: C21H22BrN3O3S MolecularWeight: 476.38668

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCCC3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCCC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H22BrN3O3S/c1-3-25-20(27)17-12-15(22)6-9-18(17)24-21(25)29-13-19(26)23-11-10-14-4-7-16(28-2)8-5-14/h4-9,12H,3,10-11,13H2,1-2H3,(H,23,26)