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

Systemtic Name: 2-[6-bromanyl-4-oxidanylidene-3-(2-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-propyl-ethanamide Openeye Name: 2-[6-bromo-3-(2-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-propyl-acetamide CAS Name: 2-[[6-bromo-3-(2-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-propylacetamide IUPAC Name: 2-[6-bromo-3-(2-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-propylacetamide Traditional Name: 2-[[6-bromo-3-(2-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-propyl-acetamide Formula: C16H20BrN3O3S MolecularWeight: 414.3173

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1CC(C)O

Isomeric SMILES

CCCNC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1CC(C)O

InChI

InChI=1S/C16H20BrN3O3S/c1-3-6-18-14(22)9-24-16-19-13-5-4-11(17)7-12(13)15(23)20(16)8-10(2)21/h4-5,7,10,21H,3,6,8-9H2,1-2H3,(H,18,22)