N-(3-dodecyl-5-oxidanylidene-1-phenyl-4-phenylazanyl-pyrazol-4-yl)ethanamide

Systemtic Name: N-(3-dodecyl-5-oxidanylidene-1-phenyl-4-phenylazanyl-pyrazol-4-yl)ethanamide Openeye Name: N-(4-anilino-3-dodecyl-5-oxo-1-phenyl-pyrazol-4-yl)acetamide CAS Name: N-(4-anilino-3-dodecyl-5-oxo-1-phenyl-4-pyrazolyl)acetamide IUPAC Name: N-(4-anilino-3-dodecyl-5-oxo-1-phenylpyrazol-4-yl)acetamide Traditional Name: N-(4-anilino-5-keto-3-lauryl-1-phenyl-2-pyrazolin-4-yl)acetamide Formula: C29H40N4O2 MolecularWeight: 476.6535

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=NN(C(=O)C1(NC2=CC=CC=C2)NC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCC1=NN(C(=O)C1(NC2=CC=CC=C2)NC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C29H40N4O2/c1-3-4-5-6-7-8-9-10-11-18-23-27-29(30-24(2)34,31-25-19-14-12-15-20-25)28(35)33(32-27)26-21-16-13-17-22-26/h12-17,19-22,31H,3-11,18,23H2,1-2H3,(H,30,34)