ethyl 4-[[1-[(3-azanylpyridin-2-yl)methyl]benzimidazol-2-yl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-[(3-azanylpyridin-2-yl)methyl]benzimidazol-2-yl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-[(3-amino-2-pyridyl)methyl]benzimidazol-2-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[1-[(3-amino-2-pyridinyl)methyl]-2-benzimidazolyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-[(3-aminopyridin-2-yl)methyl]benzimidazol-2-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-[(3-amino-2-pyridyl)methyl]benzimidazol-2-yl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC2=NC3=CC=CC=C3N2CC4=C(C=CC=N4)N

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC2=NC3=CC=CC=C3N2CC4=C(C=CC=N4)N

InChI

InChI=1S/C21H26N6O2/c1-2-29-21(28)26-12-9-15(10-13-26)24-20-25-17-7-3-4-8-19(17)27(20)14-18-16(22)6-5-11-23-18/h3-8,11,15H,2,9-10,12-14,22H2,1H3,(H,24,25)