2-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-6-chloranyl-benzimidazol-1-yl]ethanol

Systemtic Name: 2-[2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-6-chloranyl-benzimidazol-1-yl]ethanol Openeye Name: 2-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-6-chloro-benzimidazol-1-yl]ethanol CAS Name: 2-[2-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-6-chloro-1-benzimidazolyl]ethanol IUPAC Name: 2-[2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-6-chlorobenzimidazol-1-yl]ethanol Traditional Name: 2-[2-[[(5-amino-1H-1,2,4-triazol-3-yl)thio]methyl]-6-chloro-benzimidazol-1-yl]ethanol Formula: C12H13ClN6OS MolecularWeight: 324.78922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)N(C(=N2)CSC3=NNC(=N3)N)CCO

Isomeric SMILES

C1=CC2=C(C=C1Cl)N(C(=N2)CSC3=NNC(=N3)N)CCO

InChI

InChI=1S/C12H13ClN6OS/c13-7-1-2-8-9(5-7)19(3-4-20)10(15-8)6-21-12-16-11(14)17-18-12/h1-2,5,20H,3-4,6H2,(H3,14,16,17,18)