2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole

Systemtic Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole Openeye Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole CAS Name: 2-[[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1H-benzimidazole IUPAC Name: 2-[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole Traditional Name: 2-[[(5-ethyl-4-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1H-benzimidazole Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1C2=CC=CC=C2)SCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCC1=NN=C(N1C2=CC=CC=C2)SCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C18H17N5S/c1-2-17-21-22-18(23(17)13-8-4-3-5-9-13)24-12-16-19-14-10-6-7-11-15(14)20-16/h3-11H,2,12H2,1H3,(H,19,20)