ethyl 4-[1-(1-benzothiophen-3-ylmethyl)-5-methoxy-benzimidazol-2-yl]sulfanylbutanoate

Systemtic Name: ethyl 4-[1-(1-benzothiophen-3-ylmethyl)-5-methoxy-benzimidazol-2-yl]sulfanylbutanoate Openeye Name: ethyl 4-[1-(benzothiophen-3-ylmethyl)-5-methoxy-benzimidazol-2-yl]sulfanylbutanoate CAS Name: 4-[[1-(1-benzothiophen-3-ylmethyl)-5-methoxy-2-benzimidazolyl]thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[1-(1-benzothiophen-3-ylmethyl)-5-methoxybenzimidazol-2-yl]sulfanylbutanoate Traditional Name: 4-[[1-(benzothiophen-3-ylmethyl)-5-methoxy-benzimidazol-2-yl]thio]butyric acid ethyl ester Formula: C23H24N2O3S2 MolecularWeight: 440.57826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCSC1=NC2=C(N1CC3=CSC4=CC=CC=C43)C=CC(=C2)OC

Isomeric SMILES

CCOC(=O)CCCSC1=NC2=C(N1CC3=CSC4=CC=CC=C43)C=CC(=C2)OC

InChI

InChI=1S/C23H24N2O3S2/c1-3-28-22(26)9-6-12-29-23-24-19-13-17(27-2)10-11-20(19)25(23)14-16-15-30-21-8-5-4-7-18(16)21/h4-5,7-8,10-11,13,15H,3,6,9,12,14H2,1-2H3