N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl-methyl-sulfamoyl]-N-ethyl-ethanamine

Systemtic Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl-methyl-sulfamoyl]-N-ethyl-ethanamine Openeye Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-pyrazol-4-yl]methyl-methyl-sulfamoyl]-N-ethyl-ethanamine CAS Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenyl-4-pyrazolyl]methyl-methylsulfamoyl]-N-ethylethanamine IUPAC Name: N-[[1-[(2-chlorophenyl)methyl]-3-phenylpyrazol-4-yl]methyl-methylsulfamoyl]-N-ethylethanamine Traditional Name: [1-(2-chlorobenzyl)-3-phenyl-pyrazol-4-yl]methyl-(diethylsulfamoyl)-methyl-amine Formula: C22H27ClN4O2S MolecularWeight: 446.99338

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)N(C)CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCN(CC)S(=O)(=O)N(C)CC1=CN(N=C1C2=CC=CC=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C22H27ClN4O2S/c1-4-27(5-2)30(28,29)25(3)15-20-17-26(16-19-13-9-10-14-21(19)23)24-22(20)18-11-7-6-8-12-18/h6-14,17H,4-5,15-16H2,1-3H3