3-[3-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-pyridin-4-yl]sulfanylpropylsulfanyl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[3-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-pyridin-4-yl]sulfanylpropylsulfanyl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[3-[[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methyl-4-pyridyl]sulfanyl]propylsulfanyl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[3-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridinyl]thio]propylthio]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[3-[2-(1H-benzimidazol-2-ylsulfanylmethyl)-3-methylpyridin-4-yl]sulfanylpropylsulfanyl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[3-[[2-[(1H-benzimidazol-2-ylthio)methyl]-3-methyl-4-pyridyl]thio]propylthio]-1H-1,2,4-triazol-5-yl]amine Formula: C19H21N7S3 MolecularWeight: 443.61194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)SCCCSC4=NNC(=N4)N

Isomeric SMILES

CC1=C(C=CN=C1CSC2=NC3=CC=CC=C3N2)SCCCSC4=NNC(=N4)N

InChI

InChI=1S/C19H21N7S3/c1-12-15(11-29-18-22-13-5-2-3-6-14(13)23-18)21-8-7-16(12)27-9-4-10-28-19-24-17(20)25-26-19/h2-3,5-8H,4,9-11H2,1H3,(H,22,23)(H3,20,24,25,26)