methyl 2-ethylsulfanyl-1-(2-methylpropyl)benzimidazole-5-carboxylate

Systemtic Name: methyl 2-ethylsulfanyl-1-(2-methylpropyl)benzimidazole-5-carboxylate Openeye Name: methyl 2-ethylsulfanyl-1-isobutyl-benzimidazole-5-carboxylate CAS Name: 2-(ethylthio)-1-(2-methylpropyl)-5-benzimidazolecarboxylic acid methyl ester IUPAC Name: methyl 2-ethylsulfanyl-1-(2-methylpropyl)benzimidazole-5-carboxylate Traditional Name: 2-(ethylthio)-1-isobutyl-benzimidazole-5-carboxylic acid methyl ester Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(N1CC(C)C)C=CC(=C2)C(=O)OC

Isomeric SMILES

CCSC1=NC2=C(N1CC(C)C)C=CC(=C2)C(=O)OC

InChI

InChI=1S/C15H20N2O2S/c1-5-20-15-16-12-8-11(14(18)19-4)6-7-13(12)17(15)9-10(2)3/h6-8,10H,5,9H2,1-4H3