N-[[5-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline

Systemtic Name: N-[[5-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline Openeye Name: N-[[5-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline CAS Name: N-[[5-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline IUPAC Name: N-[[5-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]-4-phenyl-1,2,4-triazol-3-yl]methyl]aniline Traditional Name: [5-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-4-phenyl-1,2,4-triazol-3-yl]methyl-phenyl-amine Formula: C24H22N6S MolecularWeight: 426.53668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)CSC3=NN=C(N3C4=CC=CC=C4)CNC5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)CSC3=NN=C(N3C4=CC=CC=C4)CNC5=CC=CC=C5

InChI

InChI=1S/C24H22N6S/c1-17-12-13-20-21(14-17)27-22(26-20)16-31-24-29-28-23(15-25-18-8-4-2-5-9-18)30(24)19-10-6-3-7-11-19/h2-14,25H,15-16H2,1H3,(H,26,27)