4-[(4E)-4-[[(2-ethylphenyl)amino]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]-N,N-dihexyl-benzamide

Systemtic Name: 4-[(4E)-4-[[(2-ethylphenyl)amino]methylidene]-3-methyl-5-oxidanylidene-pyrazol-1-yl]-N,N-dihexyl-benzamide Openeye Name: 4-[(4E)-4-[(2-ethylanilino)methylene]-3-methyl-5-oxo-pyrazol-1-yl]-N,N-dihexyl-benzamide CAS Name: 4-[(4E)-4-[(2-ethylanilino)methylidene]-3-methyl-5-oxo-1-pyrazolyl]-N,N-dihexylbenzamide IUPAC Name: 4-[(4E)-4-[(2-ethylanilino)methylidene]-3-methyl-5-oxopyrazol-1-yl]-N,N-dihexylbenzamide Traditional Name: 4-[(4E)-4-[(2-ethylanilino)methylene]-5-keto-3-methyl-2-pyrazolin-1-yl]-N,N-dihexyl-benzamide Formula: C32H44N4O2 MolecularWeight: 516.71736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN(CCCCCC)C(=O)C1=CC=C(C=C1)N2C(=O)C(=CNC3=CC=CC=C3CC)C(=N2)C

Isomeric SMILES

CCCCCCN(CCCCCC)C(=O)C1=CC=C(C=C1)N2C(=O)/C(=C/NC3=CC=CC=C3CC)/C(=N2)C

InChI

InChI=1S/C32H44N4O2/c1-5-8-10-14-22-35(23-15-11-9-6-2)31(37)27-18-20-28(21-19-27)36-32(38)29(25(4)34-36)24-33-30-17-13-12-16-26(30)7-3/h12-13,16-21,24,33H,5-11,14-15,22-23H2,1-4H3/b29-24+