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

Systemtic Name: 5-chloranyl-1-(phenylmethyl)-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazole Openeye Name: 1-benzyl-5-chloro-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazole CAS Name: 5-chloro-1-(phenylmethyl)-2-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]benzimidazole IUPAC Name: 1-benzyl-5-chloro-2-[(4-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzimidazole Traditional Name: 1-benzyl-5-chloro-2-[[(4-phenyl-1,2,4-triazol-3-yl)thio]methyl]benzimidazole Formula: C23H18ClN5S MolecularWeight: 431.94052

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2CSC4=NN=CN4C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2CSC4=NN=CN4C5=CC=CC=C5

InChI

InChI=1S/C23H18ClN5S/c24-18-11-12-21-20(13-18)26-22(28(21)14-17-7-3-1-4-8-17)15-30-23-27-25-16-29(23)19-9-5-2-6-10-19/h1-13,16H,14-15H2