(3-chloranyl-1-benzothiophen-2-yl)-[3-(5-nitrothiophen-2-yl)-5-phenyl-pyrazol-1-yl]methanone

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)-[3-(5-nitrothiophen-2-yl)-5-phenyl-pyrazol-1-yl]methanone Openeye Name: (3-chlorobenzothiophen-2-yl)-[3-(5-nitro-2-thienyl)-5-phenyl-pyrazol-1-yl]methanone CAS Name: (3-chloro-1-benzothiophen-2-yl)-[3-(5-nitro-2-thiophenyl)-5-phenyl-1-pyrazolyl]methanone IUPAC Name: (3-chloro-1-benzothiophen-2-yl)-[3-(5-nitrothiophen-2-yl)-5-phenylpyrazol-1-yl]methanone Traditional Name: (3-chlorobenzothiophen-2-yl)-[3-(5-nitro-2-thienyl)-5-phenyl-pyrazol-1-yl]methanone Formula: C22H12ClN3O3S2 MolecularWeight: 465.93198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NN2C(=O)C3=C(C4=CC=CC=C4S3)Cl)C5=CC=C(S5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NN2C(=O)C3=C(C4=CC=CC=C4S3)Cl)C5=CC=C(S5)[N+](=O)[O-]

InChI

InChI=1S/C22H12ClN3O3S2/c23-20-14-8-4-5-9-17(14)31-21(20)22(27)25-16(13-6-2-1-3-7-13)12-15(24-25)18-10-11-19(30-18)26(28)29/h1-12H