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

Systemtic Name: N-[4-bromanyl-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-ethoxy-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-ethoxy-benzenesulfonamide CAS Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-4-ethoxybenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]-4-ethoxybenzenesulfonamide Traditional Name: N-[4-bromo-1-(2,4-dichlorobenzyl)pyrazol-3-yl]-4-ethoxy-benzenesulfonamide Formula: C18H16BrCl2N3O3S MolecularWeight: 505.21294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NC2=NN(C=C2Br)CC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H16BrCl2N3O3S/c1-2-27-14-5-7-15(8-6-14)28(25,26)23-18-16(19)11-24(22-18)10-12-3-4-13(20)9-17(12)21/h3-9,11H,2,10H2,1H3,(H,22,23)