5-ethoxy-1-methyl-2-prop-2-enylsulfanyl-benzimidazole

Systemtic Name: 5-ethoxy-1-methyl-2-prop-2-enylsulfanyl-benzimidazole Openeye Name: 2-allylsulfanyl-5-ethoxy-1-methyl-benzimidazole CAS Name: 5-ethoxy-1-methyl-2-(prop-2-enylthio)benzimidazole IUPAC Name: 5-ethoxy-1-methyl-2-prop-2-enylsulfanylbenzimidazole Traditional Name: 2-(allylthio)-5-ethoxy-1-methyl-benzimidazole Formula: C13H16N2OS MolecularWeight: 248.34394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=N2)SCC=C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=N2)SCC=C)C

InChI

InChI=1S/C13H16N2OS/c1-4-8-17-13-14-11-9-10(16-5-2)6-7-12(11)15(13)3/h4,6-7,9H,1,5,8H2,2-3H3