(4-chlorophenyl)-[3-(5-nitrothiophen-2-yl)-1-phenyl-pyrazol-4-yl]methanone

Systemtic Name: (4-chlorophenyl)-[3-(5-nitrothiophen-2-yl)-1-phenyl-pyrazol-4-yl]methanone Openeye Name: (4-chlorophenyl)-[3-(5-nitro-2-thienyl)-1-phenyl-pyrazol-4-yl]methanone CAS Name: (4-chlorophenyl)-[3-(5-nitro-2-thiophenyl)-1-phenyl-4-pyrazolyl]methanone IUPAC Name: (4-chlorophenyl)-[3-(5-nitrothiophen-2-yl)-1-phenylpyrazol-4-yl]methanone Traditional Name: (4-chlorophenyl)-[3-(5-nitro-2-thienyl)-1-phenyl-pyrazol-4-yl]methanone Formula: C20H12ClN3O3S MolecularWeight: 409.84558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(S3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(S3)[N+](=O)[O-])C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H12ClN3O3S/c21-14-8-6-13(7-9-14)20(25)16-12-23(15-4-2-1-3-5-15)22-19(16)17-10-11-18(28-17)24(26)27/h1-12H