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

Systemtic Name: 2-[6-[3-(4-ethylpiperazin-1-yl)propyl-methyl-amino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[6-[3-(4-ethylpiperazin-1-yl)propyl-methyl-amino]-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[6-[3-(4-ethyl-1-piperazinyl)propyl-methylamino]-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[6-[3-(4-ethylpiperazin-1-yl)propyl-methylamino]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[6-[3-(4-ethylpiperazino)propyl-methyl-amino]-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C23H31N7O MolecularWeight: 421.53854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N7O/c1-3-29-12-14-30(15-13-29)11-5-10-28(2)20-9-8-17(16-25-20)23-26-19-7-4-6-18(22(24)31)21(19)27-23/h4,6-9,16H,3,5,10-15H2,1-2H3,(H2,24,31)(H,26,27)