N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxidanylidene-5-phenyl-1H-pyrazol-4-yl]-2-oxidanylidene-ethyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxo-ethyl]-2-phenylsulfanyl-acetamide CAS Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxoethyl]-2-(phenylthio)acetamide IUPAC Name: N-butyl-N-[2-[2-(2-ethylphenyl)-3-oxo-5-phenyl-1H-pyrazol-4-yl]-2-oxoethyl]-2-phenylsulfanylacetamide Traditional Name: N-butyl-N-[2-[1-(2-ethylphenyl)-5-keto-3-phenyl-3-pyrazolin-4-yl]-2-keto-ethyl]-2-(phenylthio)acetamide Formula: C31H33N3O3S MolecularWeight: 527.67702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC=C2CC)C3=CC=CC=C3)C(=O)CSC4=CC=CC=C4

Isomeric SMILES

CCCCN(CC(=O)C1=C(NN(C1=O)C2=CC=CC=C2CC)C3=CC=CC=C3)C(=O)CSC4=CC=CC=C4

InChI

InChI=1S/C31H33N3O3S/c1-3-5-20-33(28(36)22-38-25-17-10-7-11-18-25)21-27(35)29-30(24-15-8-6-9-16-24)32-34(31(29)37)26-19-13-12-14-23(26)4-2/h6-19,32H,3-5,20-22H2,1-2H3