(5-bromanyl-2-ethylsulfanyl-benzimidazol-1-yl)methyl 2,2-dimethylpropanoate

Systemtic Name: (5-bromanyl-2-ethylsulfanyl-benzimidazol-1-yl)methyl 2,2-dimethylpropanoate Openeye Name: (5-bromo-2-ethylsulfanyl-benzimidazol-1-yl)methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [5-bromo-2-(ethylthio)-1-benzimidazolyl]methyl ester IUPAC Name: (5-bromo-2-ethylsulfanylbenzimidazol-1-yl)methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [5-bromo-2-(ethylthio)benzimidazol-1-yl]methyl ester Formula: C15H19BrN2O2S MolecularWeight: 371.29256

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(N1COC(=O)C(C)(C)C)C=CC(=C2)Br

Isomeric SMILES

CCSC1=NC2=C(N1COC(=O)C(C)(C)C)C=CC(=C2)Br

InChI

InChI=1S/C15H19BrN2O2S/c1-5-21-14-17-11-8-10(16)6-7-12(11)18(14)9-20-13(19)15(2,3)4/h6-8H,5,9H2,1-4H3