3-[(6-chloranyl-1H-benzimidazol-2-yl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(6-chloranyl-1H-benzimidazol-2-yl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-allyl-3-[(6-chloro-1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-5-thione CAS Name: 3-[(6-chloro-1H-benzimidazol-2-yl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(6-chloro-1H-benzimidazol-2-yl)methyl]-4-prop-2-enyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-allyl-3-[(6-chloro-1H-benzimidazol-2-yl)methyl]-1H-1,2,4-triazole-5-thione Formula: C13H12ClN5S MolecularWeight: 305.78588

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NNC1=S)CC2=NC3=C(N2)C=C(C=C3)Cl

Isomeric SMILES

C=CCN1C(=NNC1=S)CC2=NC3=C(N2)C=C(C=C3)Cl

InChI

InChI=1S/C13H12ClN5S/c1-2-5-19-12(17-18-13(19)20)7-11-15-9-4-3-8(14)6-10(9)16-11/h2-4,6H,1,5,7H2,(H,15,16)(H,18,20)