1-(1-adamantyl)-4-chloranyl-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-4-chloranyl-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-4-chloro-N-[4-(o-tolylsulfamoyl)phenyl]pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-4-chloro-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-4-chloro-N-[4-[(2-methylphenyl)sulfamoyl]phenyl]pyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-4-chloro-N-[4-(o-tolylsulfamoyl)phenyl]pyrazole-3-carboxamide Formula: C27H29ClN4O3S MolecularWeight: 525.06216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=C3Cl)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=C3Cl)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H29ClN4O3S/c1-17-4-2-3-5-24(17)31-36(34,35)22-8-6-21(7-9-22)29-26(33)25-23(28)16-32(30-25)27-13-18-10-19(14-27)12-20(11-18)15-27/h2-9,16,18-20,31H,10-15H2,1H3,(H,29,33)