4-bromanyl-N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: 4-bromanyl-N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-bromo-N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]benzamide CAS Name: 4-bromo-N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]benzamide IUPAC Name: 4-bromo-N-butyl-N-[2-[[2-(4-methoxyphenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]benzamide Traditional Name: 4-bromo-N-butyl-N-[2-keto-2-[[2-(4-methoxyphenyl)-5-phenyl-pyrazol-3-yl]amino]ethyl]benzamide Formula: C29H29BrN4O3 MolecularWeight: 561.46956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CCCCN(CC(=O)NC1=CC(=NN1C2=CC=C(C=C2)OC)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C29H29BrN4O3/c1-3-4-18-33(29(36)22-10-12-23(30)13-11-22)20-28(35)31-27-19-26(21-8-6-5-7-9-21)32-34(27)24-14-16-25(37-2)17-15-24/h5-17,19H,3-4,18,20H2,1-2H3,(H,31,35)