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

Systemtic Name: 4-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]-N-propyl-benzamide Openeye Name: 4-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxo-ethyl]-N-propyl-benzamide CAS Name: 4-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]-N-propylbenzamide IUPAC Name: 4-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]-N-propylbenzamide Traditional Name: 4-butyl-N-[2-[[2-(4-fluorophenyl)-5-phenyl-pyrazol-3-yl]amino]-2-keto-ethyl]-N-propyl-benzamide Formula: C31H33FN4O2 MolecularWeight: 512.617723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCC)CC(=O)NC2=CC(=NN2C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCC)CC(=O)NC2=CC(=NN2C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C31H33FN4O2/c1-3-5-9-23-12-14-25(15-13-23)31(38)35(20-4-2)22-30(37)33-29-21-28(24-10-7-6-8-11-24)34-36(29)27-18-16-26(32)17-19-27/h6-8,10-19,21H,3-5,9,20,22H2,1-2H3,(H,33,37)