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

Systemtic Name: 2-[4-[3-(4-methylpiperazin-1-yl)propoxy]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[3-(4-methylpiperazin-1-yl)propoxy]-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[3-(4-methyl-1-piperazinyl)propoxy]-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[3-(4-methylpiperazin-1-yl)propoxy]pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[3-(4-methylpiperazino)propoxy]-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=C(C=NC=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

Isomeric SMILES

CN1CCN(CC1)CCCOC2=C(C=NC=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

InChI

InChI=1S/C21H26N6O2/c1-26-9-11-27(12-10-26)8-3-13-29-18-6-7-23-14-16(18)21-24-17-5-2-4-15(20(22)28)19(17)25-21/h2,4-7,14H,3,8-13H2,1H3,(H2,22,28)(H,24,25)