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

Systemtic Name: 2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole Openeye Name: 2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole CAS Name: 2-[[[4-phenyl-5-(2-pyrazinyl)-1,2,4-triazol-3-yl]thio]methyl]-1H-benzimidazole IUPAC Name: 2-[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1H-benzimidazole Traditional Name: 2-[[(4-phenyl-5-pyrazin-2-yl-1,2,4-triazol-3-yl)thio]methyl]-1H-benzimidazole Formula: C20H15N7S MolecularWeight: 385.445

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4N3)C5=NC=CN=C5

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4N3)C5=NC=CN=C5

InChI

InChI=1S/C20H15N7S/c1-2-6-14(7-3-1)27-19(17-12-21-10-11-22-17)25-26-20(27)28-13-18-23-15-8-4-5-9-16(15)24-18/h1-12H,13H2,(H,23,24)