6-[(4-bromanyl-2-chloranyl-phenyl)amino]-3-methyl-N-(3-oxidanylpropoxy)benzimidazole-5-carboxamide

Systemtic Name: 6-[(4-bromanyl-2-chloranyl-phenyl)amino]-3-methyl-N-(3-oxidanylpropoxy)benzimidazole-5-carboxamide Openeye Name: 6-(4-bromo-2-chloro-anilino)-N-(3-hydroxypropoxy)-3-methyl-benzimidazole-5-carboxamide CAS Name: 6-(4-bromo-2-chloroanilino)-N-(3-hydroxypropoxy)-3-methyl-5-benzimidazolecarboxamide IUPAC Name: 6-(4-bromo-2-chloroanilino)-N-(3-hydroxypropoxy)-3-methylbenzimidazole-5-carboxamide Traditional Name: 6-(4-bromo-2-chloro-anilino)-N-(3-hydroxypropoxy)-3-methyl-benzimidazole-5-carboxamide Formula: C18H18BrClN4O3 MolecularWeight: 453.71752

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=C(C(=C2)NC3=C(C=C(C=C3)Br)Cl)C(=O)NOCCCO

Isomeric SMILES

CN1C=NC2=C1C=C(C(=C2)NC3=C(C=C(C=C3)Br)Cl)C(=O)NOCCCO

InChI

InChI=1S/C18H18BrClN4O3/c1-24-10-21-16-9-15(22-14-4-3-11(19)7-13(14)20)12(8-17(16)24)18(26)23-27-6-2-5-25/h3-4,7-10,22,25H,2,5-6H2,1H3,(H,23,26)