ethyl 2-[[3-methyl-4-(2-phenylmethoxyethoxy)pyridin-2-yl]methylsulfanyl]-3H-benzimidazole-5-carboxylate

Systemtic Name: ethyl 2-[[3-methyl-4-(2-phenylmethoxyethoxy)pyridin-2-yl]methylsulfanyl]-3H-benzimidazole-5-carboxylate Openeye Name: ethyl 2-[[4-(2-benzyloxyethoxy)-3-methyl-2-pyridyl]methylsulfanyl]-3H-benzimidazole-5-carboxylate CAS Name: 2-[[3-methyl-4-(2-phenylmethoxyethoxy)-2-pyridinyl]methylthio]-3H-benzimidazole-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-methyl-4-(2-phenylmethoxyethoxy)pyridin-2-yl]methylsulfanyl]-3H-benzimidazole-5-carboxylate Traditional Name: 2-[[4-(2-benzoxyethoxy)-3-methyl-2-pyridyl]methylthio]-3H-benzimidazole-5-carboxylic acid ethyl ester Formula: C26H27N3O4S MolecularWeight: 477.57528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(N2)SCC3=NC=CC(=C3C)OCCOCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(N2)SCC3=NC=CC(=C3C)OCCOCC4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4S/c1-3-32-25(30)20-9-10-21-22(15-20)29-26(28-21)34-17-23-18(2)24(11-12-27-23)33-14-13-31-16-19-7-5-4-6-8-19/h4-12,15H,3,13-14,16-17H2,1-2H3,(H,28,29)