propan-2-yl 2-[2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]ethanoate

Systemtic Name: propan-2-yl 2-[2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]ethanoate Openeye Name: isopropyl 2-[2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]acetate CAS Name: 2-[2-[2-(3,4-dimethylphenoxy)ethylthio]-1-benzimidazolyl]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[2-[2-(3,4-dimethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]acetate Traditional Name: 2-[2-[2-(3,4-dimethylphenoxy)ethylthio]benzimidazol-1-yl]acetic acid isopropyl ester Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CC(=O)OC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CC(=O)OC(C)C)C

InChI

InChI=1S/C22H26N2O3S/c1-15(2)27-21(25)14-24-20-8-6-5-7-19(20)23-22(24)28-12-11-26-18-10-9-16(3)17(4)13-18/h5-10,13,15H,11-12,14H2,1-4H3