N-[4-(1-adamantylsulfamoyl)phenyl]-4-bromanyl-2,5-dimethyl-pyrazole-3-carboxamide

Systemtic Name: N-[4-(1-adamantylsulfamoyl)phenyl]-4-bromanyl-2,5-dimethyl-pyrazole-3-carboxamide Openeye Name: N-[4-(1-adamantylsulfamoyl)phenyl]-4-bromo-2,5-dimethyl-pyrazole-3-carboxamide CAS Name: N-[4-(1-adamantylsulfamoyl)phenyl]-4-bromo-2,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: N-[4-(1-adamantylsulfamoyl)phenyl]-4-bromo-2,5-dimethylpyrazole-3-carboxamide Traditional Name: N-[4-(1-adamantylsulfamoyl)phenyl]-4-bromo-2,5-dimethyl-pyrazole-3-carboxamide Formula: C22H27BrN4O3S MolecularWeight: 507.44378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=NN(C(=C1Br)C(=O)NC2=CC=C(C=C2)S(=O)(=O)NC34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C22H27BrN4O3S/c1-13-19(23)20(27(2)25-13)21(28)24-17-3-5-18(6-4-17)31(29,30)26-22-10-14-7-15(11-22)9-16(8-14)12-22/h3-6,14-16,26H,7-12H2,1-2H3,(H,24,28)