2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-methyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-methyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(6-bromo-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: 2-[(6-bromo-4-oxo-3-propyl-2-quinazolinyl)thio]-N-methyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(6-bromo-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-methylacetamide Traditional Name: N-benzyl-2-[(6-bromo-4-keto-3-propyl-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C21H22BrN3O2S MolecularWeight: 460.38728

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CCCN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)N(C)CC3=CC=CC=C3

InChI

InChI=1S/C21H22BrN3O2S/c1-3-11-25-20(27)17-12-16(22)9-10-18(17)23-21(25)28-14-19(26)24(2)13-15-7-5-4-6-8-15/h4-10,12H,3,11,13-14H2,1-2H3