2-[5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]-3-phenyl-1H-pyrazol-4-yl]-1H-benzimidazole

Systemtic Name: 2-[5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]-3-phenyl-1H-pyrazol-4-yl]-1H-benzimidazole Openeye Name: 2-[5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]-3-phenyl-1H-pyrazol-4-yl]-1H-benzimidazole CAS Name: 2-[5-[4-[[(4,6-dimethyl-2-pyrimidinyl)thio]methyl]phenyl]-3-phenyl-1H-pyrazol-4-yl]-1H-benzimidazole IUPAC Name: 2-[5-[4-[(4,6-dimethylpyrimidin-2-yl)sulfanylmethyl]phenyl]-3-phenyl-1H-pyrazol-4-yl]-1H-benzimidazole Traditional Name: 2-[5-[4-[[(4,6-dimethylpyrimidin-2-yl)thio]methyl]phenyl]-3-phenyl-1H-pyrazol-4-yl]-1H-benzimidazole Formula: C29H24N6S MolecularWeight: 488.60606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C3=C(C(=NN3)C4=CC=CC=C4)C5=NC6=CC=CC=C6N5)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC=C(C=C2)C3=C(C(=NN3)C4=CC=CC=C4)C5=NC6=CC=CC=C6N5)C

InChI

InChI=1S/C29H24N6S/c1-18-16-19(2)31-29(30-18)36-17-20-12-14-22(15-13-20)27-25(26(34-35-27)21-8-4-3-5-9-21)28-32-23-10-6-7-11-24(23)33-28/h3-16H,17H2,1-2H3,(H,32,33)(H,34,35)