2-(2-bromanylbenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-(pyridin-3-ylmethyl)butanamide

Systemtic Name: 2-(2-bromanylbenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-(pyridin-3-ylmethyl)butanamide Openeye Name: 2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-(3-pyridylmethyl)butanamide CAS Name: 2-[(2-bromo-6-benzimidazolo[1,2-c]quinazolinyl)thio]-N-(3-pyridinylmethyl)butanamide IUPAC Name: 2-(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)sulfanyl-N-(pyridin-3-ylmethyl)butanamide Traditional Name: 2-[(2-bromobenzimidazolo[1,2-c]quinazolin-6-yl)thio]-N-(3-pyridylmethyl)butyramide Formula: C24H20BrN5OS MolecularWeight: 506.4175

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CN=CC=C1)SC2=NC3=C(C=C(C=C3)Br)C4=NC5=CC=CC=C5N42

Isomeric SMILES

CCC(C(=O)NCC1=CN=CC=C1)SC2=NC3=C(C=C(C=C3)Br)C4=NC5=CC=CC=C5N42

InChI

InChI=1S/C24H20BrN5OS/c1-2-21(23(31)27-14-15-6-5-11-26-13-15)32-24-29-18-10-9-16(25)12-17(18)22-28-19-7-3-4-8-20(19)30(22)24/h3-13,21H,2,14H2,1H3,(H,27,31)