3-[2-[2-(3-methylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propanoate

Systemtic Name: 3-[2-[2-(3-methylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propanoate Openeye Name: 3-[2-[2-(3-methylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propanoate CAS Name: 3-[2-[2-(3-methylphenoxy)ethylthio]-1-benzimidazolyl]propanoate IUPAC Name: 3-[2-[2-(3-methylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propanoate Traditional Name: 3-[2-[2-(3-methylphenoxy)ethylthio]benzimidazol-1-yl]propionate Formula: C19H19N2O3S- MolecularWeight: 355.43076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCSC2=NC3=CC=CC=C3N2CCC(=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)OCCSC2=NC3=CC=CC=C3N2CCC(=O)[O-]

InChI

InChI=1S/C19H20N2O3S/c1-14-5-4-6-15(13-14)24-11-12-25-19-20-16-7-2-3-8-17(16)21(19)10-9-18(22)23/h2-8,13H,9-12H2,1H3,(H,22,23)/p-1