2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-1H-benzimidazole

Systemtic Name: 2-[(6-chloranyl-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-1H-benzimidazole Openeye Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-1H-benzimidazole CAS Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-4-methyl-1H-benzimidazole IUPAC Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylsulfanyl]-4-methyl-1H-benzimidazole Traditional Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methylthio]-4-methyl-1H-benzimidazole Formula: C16H13ClN2O2S MolecularWeight: 332.80462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC(=N2)SCC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

CC1=C2C(=CC=C1)NC(=N2)SCC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C16H13ClN2O2S/c1-9-3-2-4-12-15(9)19-16(18-12)22-7-10-5-13-14(6-11(10)17)21-8-20-13/h2-6H,7-8H2,1H3,(H,18,19)