ethyl 2-[2-[2-(2,5-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]ethanoate

Systemtic Name: ethyl 2-[2-[2-(2,5-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]ethanoate Openeye Name: ethyl 2-[2-[2-(2,5-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[2-(2,5-dimethylphenoxy)ethylthio]-1-benzimidazolyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(2,5-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[2-(2,5-dimethylphenoxy)ethylthio]benzimidazol-1-yl]acetic acid ethyl ester Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2N=C1SCCOC3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2N=C1SCCOC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H24N2O3S/c1-4-25-20(24)14-23-18-8-6-5-7-17(18)22-21(23)27-12-11-26-19-13-15(2)9-10-16(19)3/h5-10,13H,4,11-12,14H2,1-3H3