N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2,4-dimethoxy-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2,4-dimethoxy-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2,4-dimethoxy-benzenesulfonamide CAS Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]-3-pyrazolyl]-2,4-dimethoxybenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(2-chlorophenyl)methyl]pyrazol-3-yl]-2,4-dimethoxybenzenesulfonamide Traditional Name: N-[4-bromo-1-(2-chlorobenzyl)pyrazol-3-yl]-2,4-dimethoxy-benzenesulfonamide Formula: C18H17BrClN3O4S MolecularWeight: 486.76728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC=CC=C3Cl)OC

InChI

InChI=1S/C18H17BrClN3O4S/c1-26-13-7-8-17(16(9-13)27-2)28(24,25)22-18-14(19)11-23(21-18)10-12-5-3-4-6-15(12)20/h3-9,11H,10H2,1-2H3,(H,21,22)