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

Systemtic Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)methylsulfanyl]-1H-benzimidazole Openeye Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)methylsulfanyl]-1H-benzimidazole CAS Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)methylthio]-1H-benzimidazole IUPAC Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)methylsulfanyl]-1H-benzimidazole Traditional Name: 2-[(3-phenyl-1H-1,2,4-triazol-5-yl)methylthio]-1H-benzimidazole Formula: C16H13N5S MolecularWeight: 307.37292

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NNC(=N2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1=CC=C(C=C1)C2=NNC(=N2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C16H13N5S/c1-2-6-11(7-3-1)15-19-14(20-21-15)10-22-16-17-12-8-4-5-9-13(12)18-16/h1-9H,10H2,(H,17,18)(H,19,20,21)