N'-(4-butylphenyl)-1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]pyrrole-2-carbohydrazide

Systemtic Name: N'-(4-butylphenyl)-1-[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]pyrrole-2-carbohydrazide Openeye Name: N'-(4-butylphenyl)-1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]pyrrole-2-carbohydrazide CAS Name: N'-(4-butylphenyl)-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-pyrrolecarbohydrazide IUPAC Name: N'-(4-butylphenyl)-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]pyrrole-2-carbohydrazide Traditional Name: N'-(4-butylphenyl)-1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]pyrrole-2-carbohydrazide Formula: C21H20ClF3N4O MolecularWeight: 436.85791

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NNC(=O)C2=CC=CN2C3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)NNC(=O)C2=CC=CN2C3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C21H20ClF3N4O/c1-2-3-5-14-7-9-16(10-8-14)27-28-20(30)18-6-4-11-29(18)19-17(22)12-15(13-26-19)21(23,24)25/h4,6-13,27H,2-3,5H2,1H3,(H,28,30)