1-[(1-phenylpyrazol-4-yl)methyl]-3-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]urea

Systemtic Name: 1-[(1-phenylpyrazol-4-yl)methyl]-3-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]urea Openeye Name: 1-[[2-(isopropylsulfamoylmethyl)phenyl]methyl]-3-[(1-phenylpyrazol-4-yl)methyl]urea CAS Name: 1-[(1-phenyl-4-pyrazolyl)methyl]-3-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]urea IUPAC Name: 1-[(1-phenylpyrazol-4-yl)methyl]-3-[[2-(propan-2-ylsulfamoylmethyl)phenyl]methyl]urea Traditional Name: 1-[2-(isopropylsulfamoylmethyl)benzyl]-3-[(1-phenylpyrazol-4-yl)methyl]urea Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)NS(=O)(=O)CC1=CC=CC=C1CNC(=O)NCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H27N5O3S/c1-17(2)26-31(29,30)16-20-9-7-6-8-19(20)14-24-22(28)23-12-18-13-25-27(15-18)21-10-4-3-5-11-21/h3-11,13,15,17,26H,12,14,16H2,1-2H3,(H2,23,24,28)