N-butyl-2-[5-methyl-3-(4-methylpiperazin-1-yl)carbonyl-pyrazol-1-yl]-N-phenyl-ethanamide

Systemtic Name: N-butyl-2-[5-methyl-3-(4-methylpiperazin-1-yl)carbonyl-pyrazol-1-yl]-N-phenyl-ethanamide Openeye Name: N-butyl-2-[5-methyl-3-(4-methylpiperazine-1-carbonyl)pyrazol-1-yl]-N-phenyl-acetamide CAS Name: N-butyl-2-[5-methyl-3-[(4-methyl-1-piperazinyl)-oxomethyl]-1-pyrazolyl]-N-phenylacetamide IUPAC Name: N-butyl-2-[5-methyl-3-(4-methylpiperazine-1-carbonyl)pyrazol-1-yl]-N-phenylacetamide Traditional Name: N-butyl-2-[5-methyl-3-(4-methylpiperazine-1-carbonyl)pyrazol-1-yl]-N-phenyl-acetamide Formula: C22H31N5O2 MolecularWeight: 397.51384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=CC=CC=C1)C(=O)CN2C(=CC(=N2)C(=O)N3CCN(CC3)C)C

Isomeric SMILES

CCCCN(C1=CC=CC=C1)C(=O)CN2C(=CC(=N2)C(=O)N3CCN(CC3)C)C

InChI

InChI=1S/C22H31N5O2/c1-4-5-11-26(19-9-7-6-8-10-19)21(28)17-27-18(2)16-20(23-27)22(29)25-14-12-24(3)13-15-25/h6-10,16H,4-5,11-15,17H2,1-3H3