6-methoxy-2-[(4-phenylsulfanylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole

Systemtic Name: 6-methoxy-2-[(4-phenylsulfanylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole Openeye Name: 6-methoxy-2-[(4-phenylsulfanyl-2-pyridyl)methylsulfinyl]-1H-benzimidazole CAS Name: 6-methoxy-2-[[4-(phenylthio)-2-pyridinyl]methylsulfinyl]-1H-benzimidazole IUPAC Name: 6-methoxy-2-[(4-phenylsulfanylpyridin-2-yl)methylsulfinyl]-1H-benzimidazole Traditional Name: 6-methoxy-2-[[4-(phenylthio)-2-pyridyl]methylsulfinyl]-1H-benzimidazole Formula: C20H17N3O2S2 MolecularWeight: 395.49788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)S(=O)CC3=NC=CC(=C3)SC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)S(=O)CC3=NC=CC(=C3)SC4=CC=CC=C4

InChI

InChI=1S/C20H17N3O2S2/c1-25-15-7-8-18-19(12-15)23-20(22-18)27(24)13-14-11-17(9-10-21-14)26-16-5-3-2-4-6-16/h2-12H,13H2,1H3,(H,22,23)