N-(4-acetamido-5-oxidanylidene-1-phenyl-4-phenylazanyl-pyrazol-3-yl)-4-[3-(phenylsulfonyl)propoxy]benzamide

Systemtic Name: N-(4-acetamido-5-oxidanylidene-1-phenyl-4-phenylazanyl-pyrazol-3-yl)-4-[3-(phenylsulfonyl)propoxy]benzamide Openeye Name: N-(4-acetamido-4-anilino-5-oxo-1-phenyl-pyrazol-3-yl)-4-[3-(benzenesulfonyl)propoxy]benzamide CAS Name: N-(4-acetamido-4-anilino-5-oxo-1-phenyl-3-pyrazolyl)-4-[3-(benzenesulfonyl)propoxy]benzamide IUPAC Name: N-(4-acetamido-4-anilino-5-oxo-1-phenylpyrazol-3-yl)-4-[3-(benzenesulfonyl)propoxy]benzamide Traditional Name: N-(4-acetamido-4-anilino-5-keto-1-phenyl-2-pyrazolin-3-yl)-4-(3-besylpropoxy)benzamide Formula: C33H31N5O6S MolecularWeight: 625.69414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(C(=NN(C1=O)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)OCCCS(=O)(=O)C4=CC=CC=C4)NC5=CC=CC=C5

Isomeric SMILES

CC(=O)NC1(C(=NN(C1=O)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)OCCCS(=O)(=O)C4=CC=CC=C4)NC5=CC=CC=C5

InChI

InChI=1S/C33H31N5O6S/c1-24(39)35-33(36-26-12-5-2-6-13-26)31(37-38(32(33)41)27-14-7-3-8-15-27)34-30(40)25-18-20-28(21-19-25)44-22-11-23-45(42,43)29-16-9-4-10-17-29/h2-10,12-21,36H,11,22-23H2,1H3,(H,35,39)(H,34,37,40)