methyl 4-[(1-ethylbenzimidazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[(1-ethylbenzimidazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(1-ethylbenzimidazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(1-ethyl-2-benzimidazolyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-ethylbenzimidazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(1-ethylbenzimidazol-2-yl)thio]methyl]benzoic acid methyl ester Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CCN1C2=CC=CC=C2N=C1SCC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C18H18N2O2S/c1-3-20-16-7-5-4-6-15(16)19-18(20)23-12-13-8-10-14(11-9-13)17(21)22-2/h4-11H,3,12H2,1-2H3