ethyl 4-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methylsulfamoyl]benzoate

Systemtic Name: ethyl 4-[[3-phenyl-1-(phenylmethyl)pyrazol-4-yl]methylsulfamoyl]benzoate Openeye Name: ethyl 4-[(1-benzyl-3-phenyl-pyrazol-4-yl)methylsulfamoyl]benzoate CAS Name: 4-[[3-phenyl-1-(phenylmethyl)-4-pyrazolyl]methylsulfamoyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(1-benzyl-3-phenylpyrazol-4-yl)methylsulfamoyl]benzoate Traditional Name: 4-[(1-benzyl-3-phenyl-pyrazol-4-yl)methylsulfamoyl]benzoic acid ethyl ester Formula: C26H25N3O4S MolecularWeight: 475.5594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)NCC2=CN(N=C2C3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H25N3O4S/c1-2-33-26(30)22-13-15-24(16-14-22)34(31,32)27-17-23-19-29(18-20-9-5-3-6-10-20)28-25(23)21-11-7-4-8-12-21/h3-16,19,27H,2,17-18H2,1H3