2-chloranyl-N-[(E)-(3-phenyl-1-thiophen-2-yl-pyrazol-4-yl)methylideneamino]-5-(trifluoromethyl)aniline

Systemtic Name: 2-chloranyl-N-[(E)-(3-phenyl-1-thiophen-2-yl-pyrazol-4-yl)methylideneamino]-5-(trifluoromethyl)aniline Openeye Name: 2-chloro-N-[(E)-[3-phenyl-1-(2-thienyl)pyrazol-4-yl]methyleneamino]-5-(trifluoromethyl)aniline CAS Name: 2-chloro-N-[(E)-(3-phenyl-1-thiophen-2-yl-4-pyrazolyl)methylideneamino]-5-(trifluoromethyl)aniline IUPAC Name: 2-chloro-N-[(E)-(3-phenyl-1-thiophen-2-ylpyrazol-4-yl)methylideneamino]-5-(trifluoromethyl)aniline Traditional Name: [2-chloro-5-(trifluoromethyl)phenyl]-[(E)-[3-phenyl-1-(2-thienyl)pyrazol-4-yl]methyleneamino]amine Formula: C21H14ClF3N4S MolecularWeight: 446.87587

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C=C2C=NNC3=C(C=CC(=C3)C(F)(F)F)Cl)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(C=C2/C=N/NC3=C(C=CC(=C3)C(F)(F)F)Cl)C4=CC=CS4

InChI

InChI=1S/C21H14ClF3N4S/c22-17-9-8-16(21(23,24)25)11-18(17)27-26-12-15-13-29(19-7-4-10-30-19)28-20(15)14-5-2-1-3-6-14/h1-13,27H/b26-12+