1-(4-bromophenyl)carbonyl-N,N-diethyl-3,5-dimethyl-pyrazole-4-sulfonamide

Systemtic Name: 1-(4-bromophenyl)carbonyl-N,N-diethyl-3,5-dimethyl-pyrazole-4-sulfonamide Openeye Name: 1-(4-bromobenzoyl)-N,N-diethyl-3,5-dimethyl-pyrazole-4-sulfonamide CAS Name: 1-[(4-bromophenyl)-oxomethyl]-N,N-diethyl-3,5-dimethyl-4-pyrazolesulfonamide IUPAC Name: 1-(4-bromobenzoyl)-N,N-diethyl-3,5-dimethylpyrazole-4-sulfonamide Traditional Name: 1-(4-bromobenzoyl)-N,N-diethyl-3,5-dimethyl-pyrazole-4-sulfonamide Formula: C16H20BrN3O3S MolecularWeight: 414.3173

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(N(N=C1C)C(=O)C2=CC=C(C=C2)Br)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(N(N=C1C)C(=O)C2=CC=C(C=C2)Br)C

InChI

InChI=1S/C16H20BrN3O3S/c1-5-19(6-2)24(22,23)15-11(3)18-20(12(15)4)16(21)13-7-9-14(17)10-8-13/h7-10H,5-6H2,1-4H3