3-(1H-benzimidazol-2-ylsulfanylmethyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-(1H-benzimidazol-2-ylsulfanylmethyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-[(1H-benzimidazol-2-ylthio)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(1H-benzimidazol-2-ylsulfanylmethyl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-[(1H-benzimidazol-2-ylthio)methyl]-1H-1,2,4-triazole-5-thione Formula: C13H13N5S2 MolecularWeight: 303.40582

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NNC1=S)CSC2=NC3=CC=CC=C3N2

Isomeric SMILES

C=CCN1C(=NNC1=S)CSC2=NC3=CC=CC=C3N2

InChI

InChI=1S/C13H13N5S2/c1-2-7-18-11(16-17-13(18)19)8-20-12-14-9-5-3-4-6-10(9)15-12/h2-6H,1,7-8H2,(H,14,15)(H,17,19)