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

Systemtic Name: 2-(6-bromanyl-4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-N-ethyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(6-bromo-4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-N-ethyl-acetamide CAS Name: 2-[(6-bromo-4-oxo-3-propyl-2-quinazolinyl)thio]-N-ethyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(6-bromo-4-oxo-3-propylquinazolin-2-yl)sulfanyl-N-ethylacetamide Traditional Name: N-benzyl-2-[(6-bromo-4-keto-3-propyl-quinazolin-2-yl)thio]-N-ethyl-acetamide Formula: C22H24BrN3O2S MolecularWeight: 474.41386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24BrN3O2S/c1-3-12-26-21(28)18-13-17(23)10-11-19(18)24-22(26)29-15-20(27)25(4-2)14-16-8-6-5-7-9-16/h5-11,13H,3-4,12,14-15H2,1-2H3