1-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(4-chloranyl-3,5-dimethyl-phenoxy)methyl]-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide Openeye Name: 1-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide CAS Name: 1-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-[(4-sulfamoylphenyl)methyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(4-chloro-3,5-dimethylphenoxy)methyl]-N-[(4-sulfamoylphenyl)methyl]pyrazole-3-carboxamide Traditional Name: 1-[(4-chloro-3,5-dimethyl-phenoxy)methyl]-N-(4-sulfamoylbenzyl)pyrazole-3-carboxamide Formula: C20H21ClN4O4S MolecularWeight: 448.92314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCN2C=CC(=N2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCN2C=CC(=N2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H21ClN4O4S/c1-13-9-16(10-14(2)19(13)21)29-12-25-8-7-18(24-25)20(26)23-11-15-3-5-17(6-4-15)30(22,27)28/h3-10H,11-12H2,1-2H3,(H,23,26)(H2,22,27,28)