5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-(2,4-dimethylphenyl)-4-phenyl-pyrazol-3-amine

Systemtic Name: 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-(2,4-dimethylphenyl)-4-phenyl-pyrazol-3-amine Openeye Name: 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-(2,4-dimethylphenyl)-4-phenyl-pyrazol-3-amine CAS Name: 5-[(1H-benzimidazol-2-ylthio)methyl]-2-(2,4-dimethylphenyl)-4-phenyl-3-pyrazolamine IUPAC Name: 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-(2,4-dimethylphenyl)-4-phenylpyrazol-3-amine Traditional Name: [5-[(1H-benzimidazol-2-ylthio)methyl]-2-(2,4-dimethylphenyl)-4-phenyl-pyrazol-3-yl]amine Formula: C25H23N5S MolecularWeight: 425.54862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C(=N2)CSC3=NC4=CC=CC=C4N3)C5=CC=CC=C5)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C(=N2)CSC3=NC4=CC=CC=C4N3)C5=CC=CC=C5)N)C

InChI

InChI=1S/C25H23N5S/c1-16-12-13-22(17(2)14-16)30-24(26)23(18-8-4-3-5-9-18)21(29-30)15-31-25-27-19-10-6-7-11-20(19)28-25/h3-14H,15,26H2,1-2H3,(H,27,28)