2-bromanyl-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-pentyl-benzamide

Systemtic Name: 2-bromanyl-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-pentyl-benzamide Openeye Name: 2-bromo-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxo-ethyl]-N-pentyl-benzamide CAS Name: 2-bromo-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)-3-pyrazolyl]amino]-2-oxoethyl]-N-pentylbenzamide IUPAC Name: 2-bromo-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-oxoethyl]-N-pentylbenzamide Traditional Name: N-amyl-2-bromo-N-[2-[[5-tert-butyl-2-(2-chlorophenyl)pyrazol-3-yl]amino]-2-keto-ethyl]benzamide Formula: C27H32BrClN4O2 MolecularWeight: 559.92558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C(C)(C)C)C(=O)C3=CC=CC=C3Br

Isomeric SMILES

CCCCCN(CC(=O)NC1=CC(=NN1C2=CC=CC=C2Cl)C(C)(C)C)C(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C27H32BrClN4O2/c1-5-6-11-16-32(26(35)19-12-7-8-13-20(19)28)18-25(34)30-24-17-23(27(2,3)4)31-33(24)22-15-10-9-14-21(22)29/h7-10,12-15,17H,5-6,11,16,18H2,1-4H3,(H,30,34)