2-[4-(azepan-1-ylmethyl)piperidin-1-yl]-N-(2-butan-2-ylpyrazol-3-yl)propanamide

Systemtic Name: 2-[4-(azepan-1-ylmethyl)piperidin-1-yl]-N-(2-butan-2-ylpyrazol-3-yl)propanamide Openeye Name: 2-[4-(azepan-1-ylmethyl)-1-piperidyl]-N-(2-sec-butylpyrazol-3-yl)propanamide CAS Name: 2-[4-(1-azepanylmethyl)-1-piperidinyl]-N-(2-butan-2-yl-3-pyrazolyl)propanamide IUPAC Name: 2-[4-(azepan-1-ylmethyl)piperidin-1-yl]-N-(2-butan-2-ylpyrazol-3-yl)propanamide Traditional Name: 2-[4-(azepan-1-ylmethyl)piperidino]-N-(2-sec-butylpyrazol-3-yl)propionamide Formula: C22H39N5O MolecularWeight: 389.57796

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=CC=N1)NC(=O)C(C)N2CCC(CC2)CN3CCCCCC3

Isomeric SMILES

CCC(C)N1C(=CC=N1)NC(=O)C(C)N2CCC(CC2)CN3CCCCCC3

InChI

InChI=1S/C22H39N5O/c1-4-18(2)27-21(9-12-23-27)24-22(28)19(3)26-15-10-20(11-16-26)17-25-13-7-5-6-8-14-25/h9,12,18-20H,4-8,10-11,13-17H2,1-3H3,(H,24,28)