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

Systemtic Name: 2-[6-bromanyl-4-oxidanylidene-3-(2-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-(3-methylbutan-2-yl)ethanamide Openeye Name: 2-[6-bromo-3-(2-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(1,2-dimethylpropyl)acetamide CAS Name: 2-[[6-bromo-3-(2-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(3-methylbutan-2-yl)acetamide IUPAC Name: 2-[6-bromo-3-(2-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-methylbutan-2-yl)acetamide Traditional Name: 2-[[6-bromo-3-(2-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(1,2-dimethylpropyl)acetamide Formula: C18H24BrN3O3S MolecularWeight: 442.37046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1CC(C)O

Isomeric SMILES

CC(C)C(C)NC(=O)CSC1=NC2=C(C=C(C=C2)Br)C(=O)N1CC(C)O

InChI

InChI=1S/C18H24BrN3O3S/c1-10(2)12(4)20-16(24)9-26-18-21-15-6-5-13(19)7-14(15)17(25)22(18)8-11(3)23/h5-7,10-12,23H,8-9H2,1-4H3,(H,20,24)