2-[(2-bromanyl-12H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)sulfanyl]-N-methyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(2-bromanyl-12H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)sulfanyl]-N-methyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(2-bromo-12H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)sulfanyl]-N-methyl-acetamide CAS Name: 2-[(2-bromo-12H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)thio]-N-methyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(2-bromo-12H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)sulfanyl]-N-methylacetamide Traditional Name: N-benzyl-2-[(2-bromo-12H-benzimidazolo[1,2-c]quinazolin-7-ium-6-yl)thio]-N-methyl-acetamide Formula: C24H20BrN4OS+ MolecularWeight: 492.4108

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)CSC2=NC3=C(C=C(C=C3)Br)C4=[N+]2C5=CC=CC=C5N4

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)CSC2=NC3=C(C=C(C=C3)Br)C4=[N+]2C5=CC=CC=C5N4

InChI

InChI=1S/C24H19BrN4OS/c1-28(14-16-7-3-2-4-8-16)22(30)15-31-24-27-19-12-11-17(25)13-18(19)23-26-20-9-5-6-10-21(20)29(23)24/h2-13H,14-15H2,1H3/p+1