[6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate

Systemtic Name: [6-chloranyl-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 2-(4-bromanyl-2-methyl-phenyl)sulfanylethanoate Openeye Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 2-(4-bromo-2-methyl-phenyl)sulfanylacetate CAS Name: 2-[(4-bromo-2-methylphenyl)thio]acetic acid [6-chloro-1-(2-hydroxyethyl)-2-benzimidazolyl]methyl ester IUPAC Name: [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl 2-(4-bromo-2-methylphenyl)sulfanylacetate Traditional Name: 2-[(4-bromo-2-methyl-phenyl)thio]acetic acid [6-chloro-1-(2-hydroxyethyl)benzimidazol-2-yl]methyl ester Formula: C19H18BrClN2O3S MolecularWeight: 469.77982

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)SCC(=O)OCC2=NC3=C(N2CCO)C=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)Br)SCC(=O)OCC2=NC3=C(N2CCO)C=C(C=C3)Cl

InChI

InChI=1S/C19H18BrClN2O3S/c1-12-8-13(20)2-5-17(12)27-11-19(25)26-10-18-22-15-4-3-14(21)9-16(15)23(18)6-7-24/h2-5,8-9,24H,6-7,10-11H2,1H3