6-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-2-(pyrrolidin-1-ylmethyl)-1H-benzimidazole

Systemtic Name: 6-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-2-(pyrrolidin-1-ylmethyl)-1H-benzimidazole Openeye Name: 6-[2-[5-(4-chlorophenyl)-2-pyridyl]ethynyl]-2-(pyrrolidin-1-ylmethyl)-1H-benzimidazole CAS Name: 6-[2-[5-(4-chlorophenyl)-2-pyridinyl]ethynyl]-2-(1-pyrrolidinylmethyl)-1H-benzimidazole IUPAC Name: 6-[2-[5-(4-chlorophenyl)pyridin-2-yl]ethynyl]-2-(pyrrolidin-1-ylmethyl)-1H-benzimidazole Traditional Name: 6-[2-[5-(4-chlorophenyl)-2-pyridyl]ethynyl]-2-(pyrrolidinomethyl)-1H-benzimidazole Formula: C25H21ClN4 MolecularWeight: 412.91404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=NC3=C(N2)C=C(C=C3)C#CC4=NC=C(C=C4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(C1)CC2=NC3=C(N2)C=C(C=C3)C#CC4=NC=C(C=C4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H21ClN4/c26-21-8-5-19(6-9-21)20-7-11-22(27-16-20)10-3-18-4-12-23-24(15-18)29-25(28-23)17-30-13-1-2-14-30/h4-9,11-12,15-16H,1-2,13-14,17H2,(H,28,29)