2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-6-methoxy-1H-benzimidazole

Systemtic Name: 2-[(7-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-6-methoxy-1H-benzimidazole Openeye Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-6-methoxy-1H-benzimidazole CAS Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-6-methoxy-1H-benzimidazole IUPAC Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-6-methoxy-1H-benzimidazole Traditional Name: 2-[(7-chloro-1,3-benzodioxol-5-yl)methylthio]-6-methoxy-1H-benzimidazole Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC3=CC4=C(C(=C3)Cl)OCO4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC3=CC4=C(C(=C3)Cl)OCO4

InChI

InChI=1S/C16H13ClN2O3S/c1-20-10-2-3-12-13(6-10)19-16(18-12)23-7-9-4-11(17)15-14(5-9)21-8-22-15/h2-6H,7-8H2,1H3,(H,18,19)