N-cyclobutyl-3-[[4-[4-(2,2-dimethylpropylcarbamoylamino)-3-fluoranyl-phenyl]carbonylpiperazin-1-yl]methyl]benzamide

Systemtic Name: N-cyclobutyl-3-[[4-[4-(2,2-dimethylpropylcarbamoylamino)-3-fluoranyl-phenyl]carbonylpiperazin-1-yl]methyl]benzamide Openeye Name: N-cyclobutyl-3-[[4-[4-(2,2-dimethylpropylcarbamoylamino)-3-fluoro-benzoyl]piperazin-1-yl]methyl]benzamide CAS Name: N-cyclobutyl-3-[[4-[[4-[[(2,2-dimethylpropylamino)-oxomethyl]amino]-3-fluorophenyl]-oxomethyl]-1-piperazinyl]methyl]benzamide IUPAC Name: N-cyclobutyl-3-[[4-[4-(2,2-dimethylpropylcarbamoylamino)-3-fluorobenzoyl]piperazin-1-yl]methyl]benzamide Traditional Name: N-cyclobutyl-3-[[4-[3-fluoro-4-(neopentylcarbamoylamino)benzoyl]piperazino]methyl]benzamide Formula: C29H38FN5O3 MolecularWeight: 523.642123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CNC(=O)NC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NC4CCC4)F

Isomeric SMILES

CC(C)(C)CNC(=O)NC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC(=C3)C(=O)NC4CCC4)F

InChI

InChI=1S/C29H38FN5O3/c1-29(2,3)19-31-28(38)33-25-11-10-22(17-24(25)30)27(37)35-14-12-34(13-15-35)18-20-6-4-7-21(16-20)26(36)32-23-8-5-9-23/h4,6-7,10-11,16-17,23H,5,8-9,12-15,18-19H2,1-3H3,(H,32,36)(H2,31,33,38)