(4-ethylpiperazin-4-ium-1-yl)-[5-methyl-1-(3-methylphenyl)-3-(2-methylpropyl)pyrazol-4-yl]methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[5-methyl-1-(3-methylphenyl)-3-(2-methylpropyl)pyrazol-4-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[3-isobutyl-5-methyl-1-(m-tolyl)pyrazol-4-yl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[5-methyl-1-(3-methylphenyl)-3-(2-methylpropyl)-4-pyrazolyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[5-methyl-1-(3-methylphenyl)-3-(2-methylpropyl)pyrazol-4-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[3-isobutyl-5-methyl-1-(m-tolyl)pyrazol-4-yl]methanone Formula: C22H33N4O+ MolecularWeight: 369.52362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2CC(C)C)C3=CC=CC(=C3)C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2CC(C)C)C3=CC=CC(=C3)C)C

InChI

InChI=1S/C22H32N4O/c1-6-24-10-12-25(13-11-24)22(27)21-18(5)26(23-20(21)14-16(2)3)19-9-7-8-17(4)15-19/h7-9,15-16H,6,10-14H2,1-5H3/p+1