methyl 2-[[4-(cyclopropylmethoxy)-3-methoxy-pyridin-2-yl]methylsulfanyl]-6-methyl-1H-benzimidazole-5-carboxylate

Systemtic Name: methyl 2-[[4-(cyclopropylmethoxy)-3-methoxy-pyridin-2-yl]methylsulfanyl]-6-methyl-1H-benzimidazole-5-carboxylate Openeye Name: methyl 2-[[4-(cyclopropylmethoxy)-3-methoxy-2-pyridyl]methylsulfanyl]-6-methyl-1H-benzimidazole-5-carboxylate CAS Name: 2-[[4-(cyclopropylmethoxy)-3-methoxy-2-pyridinyl]methylthio]-6-methyl-1H-benzimidazole-5-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(cyclopropylmethoxy)-3-methoxypyridin-2-yl]methylsulfanyl]-6-methyl-1H-benzimidazole-5-carboxylate Traditional Name: 2-[[4-(cyclopropylmethoxy)-3-methoxy-2-pyridyl]methylthio]-6-methyl-1H-benzimidazole-5-carboxylic acid methyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C(=O)OC)N=C(N2)SCC3=NC=CC(=C3OC)OCC4CC4

Isomeric SMILES

CC1=CC2=C(C=C1C(=O)OC)N=C(N2)SCC3=NC=CC(=C3OC)OCC4CC4

InChI

InChI=1S/C21H23N3O4S/c1-12-8-15-16(9-14(12)20(25)27-3)24-21(23-15)29-11-17-19(26-2)18(6-7-22-17)28-10-13-4-5-13/h6-9,13H,4-5,10-11H2,1-3H3,(H,23,24)