5-(4-bromophenyl)-3-(3-nitrophenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazole

Systemtic Name: 5-(4-bromophenyl)-3-(3-nitrophenyl)-2-(phenylsulfonyl)-3,4-dihydropyrazole Openeye Name: 2-(benzenesulfonyl)-5-(4-bromophenyl)-3-(3-nitrophenyl)-3,4-dihydropyrazole CAS Name: 2-(benzenesulfonyl)-5-(4-bromophenyl)-3-(3-nitrophenyl)-3,4-dihydropyrazole IUPAC Name: 2-(benzenesulfonyl)-5-(4-bromophenyl)-3-(3-nitrophenyl)-3,4-dihydropyrazole Traditional Name: 1-besyl-3-(4-bromophenyl)-5-(3-nitrophenyl)-2-pyrazoline Formula: C21H16BrN3O4S MolecularWeight: 486.33844

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(N(N=C1C2=CC=C(C=C2)Br)S(=O)(=O)C3=CC=CC=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16BrN3O4S/c22-17-11-9-15(10-12-17)20-14-21(16-5-4-6-18(13-16)25(26)27)24(23-20)30(28,29)19-7-2-1-3-8-19/h1-13,21H,14H2