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

Systemtic Name: 2-chloranyl-N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylideneamino]-5-(trifluoromethyl)aniline Openeye Name: 2-chloro-N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methyleneamino]-5-(trifluoromethyl)aniline CAS Name: 2-chloro-N-[(E)-[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylideneamino]-5-(trifluoromethyl)aniline IUPAC Name: 2-chloro-N-[(E)-(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylideneamino]-5-(trifluoromethyl)aniline Traditional Name: [2-chloro-5-(trifluoromethyl)phenyl]-[(E)-(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methyleneamino]amine Formula: C22H21ClF3N5 MolecularWeight: 447.88385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=C(C=CC(=C2)C(F)(F)F)Cl)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=C(C=CC(=C2)C(F)(F)F)Cl)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H21ClF3N5/c1-15-18(14-27-28-20-13-16(22(24,25)26)9-10-19(20)23)21(30-11-5-6-12-30)31(29-15)17-7-3-2-4-8-17/h2-4,7-10,13-14,28H,5-6,11-12H2,1H3/b27-14+