N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-(2-methylpropyl)-4-pentyl-benzamide

Systemtic Name: N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-(2-methylpropyl)-4-pentyl-benzamide Openeye Name: N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-isobutyl-4-pentyl-benzamide CAS Name: N-[[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-4-pyrazolyl]methyl]-N-(2-methylpropyl)-4-pentylbenzamide IUPAC Name: N-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenylpyrazol-4-yl]methyl]-N-(2-methylpropyl)-4-pentylbenzamide Traditional Name: 4-amyl-N-[[5-(4-ethylpiperazino)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-N-isobutyl-benzamide Formula: C33H47N5O MolecularWeight: 529.75918

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=C(N(N=C2C)C3=CC=CC=C3)N4CCN(CC4)CC)CC(C)C

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CC2=C(N(N=C2C)C3=CC=CC=C3)N4CCN(CC4)CC)CC(C)C

InChI

InChI=1S/C33H47N5O/c1-6-8-10-13-28-16-18-29(19-17-28)33(39)37(24-26(3)4)25-31-27(5)34-38(30-14-11-9-12-15-30)32(31)36-22-20-35(7-2)21-23-36/h9,11-12,14-19,26H,6-8,10,13,20-25H2,1-5H3