N-(4-bromanyl-2-methyl-phenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[(4-keto-3-propyl-quinazolin-2-yl)thio]acetamide Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)Br)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)Br)C

InChI

InChI=1S/C20H20BrN3O2S/c1-3-10-24-19(26)15-6-4-5-7-17(15)23-20(24)27-12-18(25)22-16-9-8-14(21)11-13(16)2/h4-9,11H,3,10,12H2,1-2H3,(H,22,25)