N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]naphthalene-2-sulfonamide

Systemtic Name: N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]naphthalene-2-sulfonamide Openeye Name: N-[4-bromo-1-(p-tolylmethyl)pyrazol-3-yl]naphthalene-2-sulfonamide CAS Name: N-[4-bromo-1-[(4-methylphenyl)methyl]-3-pyrazolyl]-2-naphthalenesulfonamide IUPAC Name: N-[4-bromo-1-[(4-methylphenyl)methyl]pyrazol-3-yl]naphthalene-2-sulfonamide Traditional Name: N-[4-bromo-1-(4-methylbenzyl)pyrazol-3-yl]naphthalene-2-sulfonamide Formula: C21H18BrN3O2S MolecularWeight: 456.35552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C=C(C(=N2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)Br

Isomeric SMILES

CC1=CC=C(C=C1)CN2C=C(C(=N2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3)Br

InChI

InChI=1S/C21H18BrN3O2S/c1-15-6-8-16(9-7-15)13-25-14-20(22)21(23-25)24-28(26,27)19-11-10-17-4-2-3-5-18(17)12-19/h2-12,14H,13H2,1H3,(H,23,24)