N-tert-butyl-6-[[4-[4-(2,2-dimethylpropylcarbamoylamino)-3-fluoranyl-phenyl]carbonylpiperazin-1-yl]methyl]pyridine-2-carboxamide

Systemtic Name: N-tert-butyl-6-[[4-[4-(2,2-dimethylpropylcarbamoylamino)-3-fluoranyl-phenyl]carbonylpiperazin-1-yl]methyl]pyridine-2-carboxamide Openeye Name: N-tert-butyl-6-[[4-[4-(2,2-dimethylpropylcarbamoylamino)-3-fluoro-benzoyl]piperazin-1-yl]methyl]pyridine-2-carboxamide CAS Name: N-tert-butyl-6-[[4-[[4-[[(2,2-dimethylpropylamino)-oxomethyl]amino]-3-fluorophenyl]-oxomethyl]-1-piperazinyl]methyl]-2-pyridinecarboxamide IUPAC Name: N-tert-butyl-6-[[4-[4-(2,2-dimethylpropylcarbamoylamino)-3-fluorobenzoyl]piperazin-1-yl]methyl]pyridine-2-carboxamide Traditional Name: N-tert-butyl-6-[[4-[3-fluoro-4-(neopentylcarbamoylamino)benzoyl]piperazino]methyl]picolinamide Formula: C28H39FN6O3 MolecularWeight: 526.646063

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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(=N3)C(=O)NC(C)(C)C)F

Isomeric SMILES

CC(C)(C)CNC(=O)NC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CC=CC(=N3)C(=O)NC(C)(C)C)F

InChI

InChI=1S/C28H39FN6O3/c1-27(2,3)18-30-26(38)32-22-11-10-19(16-21(22)29)25(37)35-14-12-34(13-15-35)17-20-8-7-9-23(31-20)24(36)33-28(4,5)6/h7-11,16H,12-15,17-18H2,1-6H3,(H,33,36)(H2,30,32,38)