2-[6-[2-(4-methylpiperazin-1-yl)ethylamino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[6-[2-(4-methylpiperazin-1-yl)ethylamino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[6-[2-(4-methylpiperazin-1-yl)ethylamino]-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[6-[2-(4-methyl-1-piperazinyl)ethylamino]-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[6-[2-(4-methylpiperazin-1-yl)ethylamino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[6-[2-(4-methylpiperazino)ethylamino]-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C20H25N7O MolecularWeight: 379.4588

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCNC2=NC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

Isomeric SMILES

CN1CCN(CC1)CCNC2=NC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

InChI

InChI=1S/C20H25N7O/c1-26-9-11-27(12-10-26)8-7-22-17-6-5-14(13-23-17)20-24-16-4-2-3-15(19(21)28)18(16)25-20/h2-6,13H,7-12H2,1H3,(H2,21,28)(H,22,23)(H,24,25)