2-(2-bromanylbenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-butyl-N-methyl-ethanamide

Systemtic Name: 2-(2-bromanylbenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-butyl-N-methyl-ethanamide Openeye Name: 2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-butyl-N-methyl-acetamide CAS Name: 2-[(2-bromo-6-benzimidazolo[1,2-c]quinazolinyl)thio]-N-butyl-N-methylacetamide IUPAC Name: 2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-butyl-N-methylacetamide Traditional Name: 2-[(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)thio]-N-butyl-N-methyl-acetamide Formula: C21H21BrN4OS MolecularWeight: 457.38664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)CSC1=NC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4N31

Isomeric SMILES

CCCCN(C)C(=O)CSC1=NC2=C(C=C(C=C2)Br)C3=NC4=CC=CC=C4N31

InChI

InChI=1S/C21H21BrN4OS/c1-3-4-11-25(2)19(27)13-28-21-24-16-10-9-14(22)12-15(16)20-23-17-7-5-6-8-18(17)26(20)21/h5-10,12H,3-4,11,13H2,1-2H3