2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(3-methoxypropyl)ethanamide

Systemtic Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(3-methoxypropyl)ethanamide Openeye Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(3-methoxypropyl)acetamide CAS Name: 2-[[2-(4-bromophenyl)-4-quinazolinyl]thio]-N-(3-methoxypropyl)acetamide IUPAC Name: 2-[2-(4-bromophenyl)quinazolin-4-yl]sulfanyl-N-(3-methoxypropyl)acetamide Traditional Name: 2-[[2-(4-bromophenyl)quinazolin-4-yl]thio]-N-(3-methoxypropyl)acetamide Formula: C20H20BrN3O2S MolecularWeight: 446.3607

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNC(=O)CSC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

Isomeric SMILES

COCCCNC(=O)CSC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H20BrN3O2S/c1-26-12-4-11-22-18(25)13-27-20-16-5-2-3-6-17(16)23-19(24-20)14-7-9-15(21)10-8-14/h2-3,5-10H,4,11-13H2,1H3,(H,22,25)