3-tert-butyl-1-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-1-(2-methylpropyl)urea

Systemtic Name: 3-tert-butyl-1-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-1-(2-methylpropyl)urea Openeye Name: 3-tert-butyl-1-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-1-isobutyl-urea CAS Name: 3-tert-butyl-1-[[5-(4-ethyl-1-piperazinyl)-3-methyl-1-phenyl-4-pyrazolyl]methyl]-1-(2-methylpropyl)urea IUPAC Name: 3-tert-butyl-1-[[5-(4-ethylpiperazin-1-yl)-3-methyl-1-phenylpyrazol-4-yl]methyl]-1-(2-methylpropyl)urea Traditional Name: 3-tert-butyl-1-[[5-(4-ethylpiperazino)-3-methyl-1-phenyl-pyrazol-4-yl]methyl]-1-isobutyl-urea Formula: C26H42N6O MolecularWeight: 454.65128

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=C(C(=NN2C3=CC=CC=C3)C)CN(CC(C)C)C(=O)NC(C)(C)C

Isomeric SMILES

CCN1CCN(CC1)C2=C(C(=NN2C3=CC=CC=C3)C)CN(CC(C)C)C(=O)NC(C)(C)C

InChI

InChI=1S/C26H42N6O/c1-8-29-14-16-30(17-15-29)24-23(21(4)28-32(24)22-12-10-9-11-13-22)19-31(18-20(2)3)25(33)27-26(5,6)7/h9-13,20H,8,14-19H2,1-7H3,(H,27,33)