4-[4-bromanyl-4-(3-methoxyphenyl)-3H-pyrazol-2-yl]benzenesulfonamide

Systemtic Name: 4-[4-bromanyl-4-(3-methoxyphenyl)-3H-pyrazol-2-yl]benzenesulfonamide Openeye Name: 4-[4-bromo-4-(3-methoxyphenyl)-3H-pyrazol-2-yl]benzenesulfonamide CAS Name: 4-[4-bromo-4-(3-methoxyphenyl)-3H-pyrazol-2-yl]benzenesulfonamide IUPAC Name: 4-[4-bromo-4-(3-methoxyphenyl)-3H-pyrazol-2-yl]benzenesulfonamide Traditional Name: 4-[4-bromo-4-(3-methoxyphenyl)-2-pyrazolin-1-yl]benzenesulfonamide Formula: C16H16BrN3O3S MolecularWeight: 410.28554

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CN(N=C2)C3=CC=C(C=C3)S(=O)(=O)N)Br

Isomeric SMILES

COC1=CC=CC(=C1)C2(CN(N=C2)C3=CC=C(C=C3)S(=O)(=O)N)Br

InChI

InChI=1S/C16H16BrN3O3S/c1-23-14-4-2-3-12(9-14)16(17)10-19-20(11-16)13-5-7-15(8-6-13)24(18,21)22/h2-10H,11H2,1H3,(H2,18,21,22)