2-nitro-N-[(E)-(3-phenyl-1-thiophen-2-yl-pyrazol-4-yl)methylideneamino]-4-(trifluoromethyl)aniline

Systemtic Name: 2-nitro-N-[(E)-(3-phenyl-1-thiophen-2-yl-pyrazol-4-yl)methylideneamino]-4-(trifluoromethyl)aniline Openeye Name: 2-nitro-N-[(E)-[3-phenyl-1-(2-thienyl)pyrazol-4-yl]methyleneamino]-4-(trifluoromethyl)aniline CAS Name: 2-nitro-N-[(E)-(3-phenyl-1-thiophen-2-yl-4-pyrazolyl)methylideneamino]-4-(trifluoromethyl)aniline IUPAC Name: 2-nitro-N-[(E)-(3-phenyl-1-thiophen-2-ylpyrazol-4-yl)methylideneamino]-4-(trifluoromethyl)aniline Traditional Name: [2-nitro-4-(trifluoromethyl)phenyl]-[(E)-[3-phenyl-1-(2-thienyl)pyrazol-4-yl]methyleneamino]amine Formula: C21H14F3N5O2S MolecularWeight: 457.42837

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N/NC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-])C4=CC=CS4

InChI

InChI=1S/C21H14F3N5O2S/c22-21(23,24)16-8-9-17(18(11-16)29(30)31)26-25-12-15-13-28(19-7-4-10-32-19)27-20(15)14-5-2-1-3-6-14/h1-13,26H/b25-12+