N,4-dibutyl-N-[2-[[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]benzamide

Systemtic Name: N,4-dibutyl-N-[2-[[2-(4-methylphenyl)-5-phenyl-pyrazol-3-yl]amino]-2-oxidanylidene-ethyl]benzamide Openeye Name: N,4-dibutyl-N-[2-oxo-2-[[5-phenyl-2-(p-tolyl)pyrazol-3-yl]amino]ethyl]benzamide CAS Name: N,4-dibutyl-N-[2-[[2-(4-methylphenyl)-5-phenyl-3-pyrazolyl]amino]-2-oxoethyl]benzamide IUPAC Name: N,4-dibutyl-N-[2-[[2-(4-methylphenyl)-5-phenylpyrazol-3-yl]amino]-2-oxoethyl]benzamide Traditional Name: N,4-dibutyl-N-[2-keto-2-[[5-phenyl-2-(p-tolyl)pyrazol-3-yl]amino]ethyl]benzamide Formula: C33H38N4O2 MolecularWeight: 522.68042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H38N4O2/c1-4-6-11-26-16-18-28(19-17-26)33(39)36(22-7-5-2)24-32(38)34-31-23-30(27-12-9-8-10-13-27)35-37(31)29-20-14-25(3)15-21-29/h8-10,12-21,23H,4-7,11,22,24H2,1-3H3,(H,34,38)