N-(1H-benzimidazol-2-ylmethyl)-2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-methyl-ethanamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-N-methyl-ethanamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-N-methyl-acetamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-2-[(4-bromo-2,5-dimethylphenyl)thio]-N-methylacetamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-2-(4-bromo-2,5-dimethylphenyl)sulfanyl-N-methylacetamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-2-[(4-bromo-2,5-dimethyl-phenyl)thio]-N-methyl-acetamide Formula: C19H20BrN3OS MolecularWeight: 418.3506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)N(C)CC2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)N(C)CC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C19H20BrN3OS/c1-12-9-17(13(2)8-14(12)20)25-11-19(24)23(3)10-18-21-15-6-4-5-7-16(15)22-18/h4-9H,10-11H2,1-3H3,(H,21,22)