N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-4-chloranyl-2,5-dimethyl-benzenesulfonamide

Systemtic Name: N-[3-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-4-chloranyl-2,5-dimethyl-benzenesulfonamide Openeye Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-chloro-2,5-dimethyl-benzenesulfonamide CAS Name: N-[3-[(4-bromo-1-pyrazolyl)methyl]phenyl]-4-chloro-2,5-dimethylbenzenesulfonamide IUPAC Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-chloro-2,5-dimethylbenzenesulfonamide Traditional Name: N-[3-[(4-bromopyrazol-1-yl)methyl]phenyl]-4-chloro-2,5-dimethyl-benzenesulfonamide Formula: C18H17BrClN3O2S MolecularWeight: 454.76848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C)S(=O)(=O)NC2=CC=CC(=C2)CN3C=C(C=N3)Br

InChI

InChI=1S/C18H17BrClN3O2S/c1-12-7-18(13(2)6-17(12)20)26(24,25)22-16-5-3-4-14(8-16)10-23-11-15(19)9-21-23/h3-9,11,22H,10H2,1-2H3