N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-1-ethyl-pyrazole-4-carboxamide

Systemtic Name: N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-1-ethyl-pyrazole-4-carboxamide Openeye Name: N-[[2-(azocan-1-yl)-3-pyridyl]methyl]-1-ethyl-pyrazole-4-carboxamide CAS Name: N-[[2-(1-azocanyl)-3-pyridinyl]methyl]-1-ethyl-4-pyrazolecarboxamide IUPAC Name: N-[[2-(azocan-1-yl)pyridin-3-yl]methyl]-1-ethylpyrazole-4-carboxamide Traditional Name: N-[[2-(azocan-1-yl)-3-pyridyl]methyl]-1-ethyl-pyrazole-4-carboxamide Formula: C19H27N5O MolecularWeight: 341.45058

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C(=O)NCC2=C(N=CC=C2)N3CCCCCCC3

Isomeric SMILES

CCN1C=C(C=N1)C(=O)NCC2=C(N=CC=C2)N3CCCCCCC3

InChI

InChI=1S/C19H27N5O/c1-2-24-15-17(14-22-24)19(25)21-13-16-9-8-10-20-18(16)23-11-6-4-3-5-7-12-23/h8-10,14-15H,2-7,11-13H2,1H3,(H,21,25)