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

Systemtic Name: 2-(6-bromanyl-3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(3-methoxyphenyl)methyl]ethanamide Openeye Name: 2-(6-bromo-3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide CAS Name: 2-[(6-bromo-3-ethyl-4-oxo-2-quinazolinyl)thio]-N-[(3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-(6-bromo-3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(3-methoxyphenyl)methyl]acetamide Traditional Name: 2-[(6-bromo-3-ethyl-4-keto-quinazolin-2-yl)thio]-N-m-anisyl-acetamide Formula: C20H20BrN3O3S MolecularWeight: 462.3601

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCC3=CC(=CC=C3)OC

Isomeric SMILES

CCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NCC3=CC(=CC=C3)OC

InChI

InChI=1S/C20H20BrN3O3S/c1-3-24-19(26)16-10-14(21)7-8-17(16)23-20(24)28-12-18(25)22-11-13-5-4-6-15(9-13)27-2/h4-10H,3,11-12H2,1-2H3,(H,22,25)