2-(4-chlorophenyl)-1-[3-(4-nitrophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone

Systemtic Name: 2-(4-chlorophenyl)-1-[3-(4-nitrophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Openeye Name: 2-(4-chlorophenyl)-1-[3-(4-nitrophenyl)-5-(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(4-chlorophenyl)-1-[3-(4-nitrophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone IUPAC Name: 2-(4-chlorophenyl)-1-[3-(4-nitrophenyl)-5-thiophen-2-yl-3,4-dihydropyrazol-2-yl]ethanone Traditional Name: 2-(4-chlorophenyl)-1-[5-(4-nitrophenyl)-3-(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C21H16ClN3O3S MolecularWeight: 425.88804

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=CS2)C(=O)CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C(N(N=C1C2=CC=CS2)C(=O)CC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16ClN3O3S/c22-16-7-3-14(4-8-16)12-21(26)24-19(13-18(23-24)20-2-1-11-29-20)15-5-9-17(10-6-15)25(27)28/h1-11,19H,12-13H2