6-(phenylmethyl)-2-prop-2-enylsulfanyl-1H-benzimidazole hydrochloride

Systemtic Name: 6-(phenylmethyl)-2-prop-2-enylsulfanyl-1H-benzimidazole hydrochloride Openeye Name: 2-allylsulfanyl-6-benzyl-1H-benzimidazole hydrochloride CAS Name: 6-(phenylmethyl)-2-(prop-2-enylthio)-1H-benzimidazole hydrochloride IUPAC Name: 6-benzyl-2-prop-2-enylsulfanyl-1H-benzimidazole hydrochloride Traditional Name: 2-(allylthio)-6-benzyl-1H-benzimidazole hydrochloride Formula: C17H17ClN2S MolecularWeight: 316.84828

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC2=C(N1)C=C(C=C2)CC3=CC=CC=C3.Cl

Isomeric SMILES

C=CCSC1=NC2=C(N1)C=C(C=C2)CC3=CC=CC=C3.Cl

InChI

InChI=1S/C17H16N2S.ClH/c1-2-10-20-17-18-15-9-8-14(12-16(15)19-17)11-13-6-4-3-5-7-13;/h2-9,12H,1,10-11H2,(H,18,19);1H