3-[2-[2-(4-ethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propanoic acid

Systemtic Name: 3-[2-[2-(4-ethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propanoic acid Openeye Name: 3-[2-[2-(4-ethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propanoic acid CAS Name: 3-[2-[2-(4-ethylphenoxy)ethylthio]-1-benzimidazolyl]propanoic acid IUPAC Name: 3-[2-[2-(4-ethylphenoxy)ethylsulfanyl]benzimidazol-1-yl]propanoic acid Traditional Name: 3-[2-[2-(4-ethylphenoxy)ethylthio]benzimidazol-1-yl]propionic acid Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CCC(=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)OCCSC2=NC3=CC=CC=C3N2CCC(=O)O

InChI

InChI=1S/C20H22N2O3S/c1-2-15-7-9-16(10-8-15)25-13-14-26-20-21-17-5-3-4-6-18(17)22(20)12-11-19(23)24/h3-10H,2,11-14H2,1H3,(H,23,24)