2-[6-[2-(4-ethylpiperazin-1-yl)ethyl-methyl-amino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[6-[2-(4-ethylpiperazin-1-yl)ethyl-methyl-amino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[6-[2-(4-ethylpiperazin-1-yl)ethyl-methyl-amino]-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[6-[2-(4-ethyl-1-piperazinyl)ethyl-methylamino]-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[6-[2-(4-ethylpiperazin-1-yl)ethyl-methylamino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[6-[2-(4-ethylpiperazino)ethyl-methyl-amino]-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C22H29N7O MolecularWeight: 407.51196

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCN(C)C2=NC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

Isomeric SMILES

CCN1CCN(CC1)CCN(C)C2=NC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

InChI

InChI=1S/C22H29N7O/c1-3-28-11-13-29(14-12-28)10-9-27(2)19-8-7-16(15-24-19)22-25-18-6-4-5-17(21(23)30)20(18)26-22/h4-8,15H,3,9-14H2,1-2H3,(H2,23,30)(H,25,26)