N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]butane-1-sulfonamide

Systemtic Name: N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]butane-1-sulfonamide Openeye Name: N-[4-bromo-1-(p-tolylmethyl)pyrazol-3-yl]butane-1-sulfonamide CAS Name: N-[4-bromo-1-[(4-methylphenyl)methyl]-3-pyrazolyl]-1-butanesulfonamide IUPAC Name: N-[4-bromo-1-[(4-methylphenyl)methyl]pyrazol-3-yl]butane-1-sulfonamide Traditional Name: N-[4-bromo-1-(4-methylbenzyl)pyrazol-3-yl]butane-1-sulfonamide Formula: C15H20BrN3O2S MolecularWeight: 386.3072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC1=NN(C=C1Br)CC2=CC=C(C=C2)C

Isomeric SMILES

CCCCS(=O)(=O)NC1=NN(C=C1Br)CC2=CC=C(C=C2)C

InChI

InChI=1S/C15H20BrN3O2S/c1-3-4-9-22(20,21)18-15-14(16)11-19(17-15)10-13-7-5-12(2)6-8-13/h5-8,11H,3-4,9-10H2,1-2H3,(H,17,18)