N-butyl-2-[4-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[1-[(2-chlorophenyl)methyl]pyrazol-4-yl]carbonylpiperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[1-[(2-chlorophenyl)methyl]pyrazole-4-carbonyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[[1-[(2-chlorophenyl)methyl]-4-pyrazolyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[1-[(2-chlorophenyl)methyl]pyrazole-4-carbonyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[1-(2-chlorobenzyl)pyrazole-4-carbonyl]piperazino]acetamide Formula: C21H28ClN5O2 MolecularWeight: 417.93232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CN(N=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C21H28ClN5O2/c1-2-3-8-23-20(28)16-25-9-11-26(12-10-25)21(29)18-13-24-27(15-18)14-17-6-4-5-7-19(17)22/h4-7,13,15H,2-3,8-12,14,16H2,1H3,(H,23,28)