1-[(4-bromophenyl)methylsulfonyl]-4-phenyl-pyrazol-3-amine

Systemtic Name: 1-[(4-bromophenyl)methylsulfonyl]-4-phenyl-pyrazol-3-amine Openeye Name: 1-[(4-bromophenyl)methylsulfonyl]-4-phenyl-pyrazol-3-amine CAS Name: 1-[(4-bromophenyl)methylsulfonyl]-4-phenyl-3-pyrazolamine IUPAC Name: 1-[(4-bromophenyl)methylsulfonyl]-4-phenylpyrazol-3-amine Traditional Name: [1-(4-bromobenzyl)sulfonyl-4-phenyl-pyrazol-3-yl]amine Formula: C16H14BrN3O2S MolecularWeight: 392.27026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN(N=C2N)S(=O)(=O)CC3=CC=C(C=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CN(N=C2N)S(=O)(=O)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H14BrN3O2S/c17-14-8-6-12(7-9-14)11-23(21,22)20-10-15(16(18)19-20)13-4-2-1-3-5-13/h1-10H,11H2,(H2,18,19)