2-[2-(3-piperazin-1-ylpropylamino)pyridin-3-yl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[2-(3-piperazin-1-ylpropylamino)pyridin-3-yl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[2-(3-piperazin-1-ylpropylamino)-3-pyridyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[2-[3-(1-piperazinyl)propylamino]-3-pyridinyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[2-(3-piperazin-1-ylpropylamino)pyridin-3-yl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[2-(3-piperazinopropylamino)-3-pyridyl]-1H-benzimidazole-4-carboxamide Formula: C20H25N7O MolecularWeight: 379.4588

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCCNC2=C(C=CC=N2)C3=NC4=C(C=CC=C4N3)C(=O)N

Isomeric SMILES

C1CN(CCN1)CCCNC2=C(C=CC=N2)C3=NC4=C(C=CC=C4N3)C(=O)N

InChI

InChI=1S/C20H25N7O/c21-18(28)14-4-1-6-16-17(14)26-20(25-16)15-5-2-7-23-19(15)24-8-3-11-27-12-9-22-10-13-27/h1-2,4-7,22H,3,8-13H2,(H2,21,28)(H,23,24)(H,25,26)