O-[4-[(1-methyl-6-methylsulfanyl-benzimidazol-2-yl)methoxy]phenyl] 2-methylpropanethioate hydrochloride

Systemtic Name: O-[4-[(1-methyl-6-methylsulfanyl-benzimidazol-2-yl)methoxy]phenyl] 2-methylpropanethioate hydrochloride Openeye Name: O-[4-[(1-methyl-6-methylsulfanyl-benzimidazol-2-yl)methoxy]phenyl] 2-methylpropanethioate hydrochloride CAS Name: 2-methylpropanethioic acid O-[4-[[1-methyl-6-(methylthio)-2-benzimidazolyl]methoxy]phenyl] ester hydrochloride IUPAC Name: O-[4-[(1-methyl-6-methylsulfanylbenzimidazol-2-yl)methoxy]phenyl] 2-methylpropanethioate hydrochloride Traditional Name: 2-methylpropanethioic acid O-[4-[[1-methyl-6-(methylthio)benzimidazol-2-yl]methoxy]phenyl] ester hydrochloride Formula: C20H23ClN2O2S2 MolecularWeight: 422.99182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=S)OC1=CC=C(C=C1)OCC2=NC3=C(N2C)C=C(C=C3)SC.Cl

Isomeric SMILES

CC(C)C(=S)OC1=CC=C(C=C1)OCC2=NC3=C(N2C)C=C(C=C3)SC.Cl

InChI

InChI=1S/C20H22N2O2S2.ClH/c1-13(2)20(25)24-15-7-5-14(6-8-15)23-12-19-21-17-10-9-16(26-4)11-18(17)22(19)3;/h5-11,13H,12H2,1-4H3;1H