5-chloranyl-6-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]pyridin-3-yl]pyridine-3-carboxylic acid

Systemtic Name: 5-chloranyl-6-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]pyridin-3-yl]pyridine-3-carboxylic acid Openeye Name: 5-chloro-6-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]-3-pyridyl]pyridine-3-carboxylic acid CAS Name: 5-chloro-6-[6-[6-(4-methyl-1-piperazinyl)-1H-benzimidazol-2-yl]-3-pyridinyl]-3-pyridinecarboxylic acid IUPAC Name: 5-chloro-6-[6-[6-(4-methylpiperazin-1-yl)-1H-benzimidazol-2-yl]pyridin-3-yl]pyridine-3-carboxylic acid Traditional Name: 5-chloro-6-[6-[6-(4-methylpiperazino)-1H-benzimidazol-2-yl]-3-pyridyl]nicotinic acid Formula: C23H21ClN6O2 MolecularWeight: 448.90484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=NC=C(C=C4)C5=C(C=C(C=N5)C(=O)O)Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC3=C(C=C2)N=C(N3)C4=NC=C(C=C4)C5=C(C=C(C=N5)C(=O)O)Cl

InChI

InChI=1S/C23H21ClN6O2/c1-29-6-8-30(9-7-29)16-3-5-18-20(11-16)28-22(27-18)19-4-2-14(12-25-19)21-17(24)10-15(13-26-21)23(31)32/h2-5,10-13H,6-9H2,1H3,(H,27,28)(H,31,32)