2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]sulfanyl]-1H-benzimidazole

Systemtic Name: 2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]sulfanyl]-1H-benzimidazole Openeye Name: 2-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]sulfanyl]-1H-benzimidazole CAS Name: 2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]thio]-1H-benzimidazole IUPAC Name: 2-[[5-(4-chlorophenyl)-4-pyridin-4-yl-1H-pyrazol-3-yl]sulfanyl]-1H-benzimidazole Traditional Name: 2-[[5-(4-chlorophenyl)-4-(4-pyridyl)-1H-pyrazol-3-yl]thio]-1H-benzimidazole Formula: C21H14ClN5S MolecularWeight: 403.88736

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=N2)SC3=NNC(=C3C4=CC=NC=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C(=C1)NC(=N2)SC3=NNC(=C3C4=CC=NC=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C21H14ClN5S/c22-15-7-5-14(6-8-15)19-18(13-9-11-23-12-10-13)20(27-26-19)28-21-24-16-3-1-2-4-17(16)25-21/h1-12H,(H,24,25)(H,26,27)