2,5-dimethyl-1-[3-(trioxidanylsulfanyl)propyl]benzimidazole

Systemtic Name: 2,5-dimethyl-1-[3-(trioxidanylsulfanyl)propyl]benzimidazole Openeye Name: 2,5-dimethyl-1-[3-(trioxidanylsulfanyl)propyl]benzimidazole CAS Name: 3-(2,5-dimethyl-1-benzimidazolyl)-1-propanesulfenic acid IUPAC Name: 2,5-dimethyl-1-[3-(trioxidanylsulfanyl)propyl]benzimidazole Traditional Name: 2,5-dimethyl-1-[3-(trioxidanylthio)propyl]benzimidazole Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=N2)C)CCCSOOO

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=N2)C)CCCSOOO

InChI

InChI=1S/C12H16N2O3S/c1-9-4-5-12-11(8-9)13-10(2)14(12)6-3-7-18-17-16-15/h4-5,8,15H,3,6-7H2,1-2H3