N-pentyl-1-[[2-pyridin-2-yl-4-[2-(trifluoromethyl)phenyl]carbonyl-piperazin-1-yl]methylideneamino]cyclopropane-1-carboxamide

Systemtic Name: N-pentyl-1-[[2-pyridin-2-yl-4-[2-(trifluoromethyl)phenyl]carbonyl-piperazin-1-yl]methylideneamino]cyclopropane-1-carboxamide Openeye Name: N-pentyl-1-[[2-(2-pyridyl)-4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]methyleneamino]cyclopropanecarboxamide CAS Name: 1-[[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-2-(2-pyridinyl)-1-piperazinyl]methylideneamino]-N-pentyl-1-cyclopropanecarboxamide IUPAC Name: N-pentyl-1-[[2-pyridin-2-yl-4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]methylideneamino]cyclopropane-1-carboxamide Traditional Name: N-amyl-1-[[2-(2-pyridyl)-4-[2-(trifluoromethyl)benzoyl]piperazino]methyleneamino]cyclopropanecarboxamide Formula: C27H32F3N5O2 MolecularWeight: 515.57049

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1(CC1)N=CN2CCN(CC2C3=CC=CC=N3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CCCCCNC(=O)C1(CC1)N=CN2CCN(CC2C3=CC=CC=N3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C27H32F3N5O2/c1-2-3-7-15-32-25(37)26(12-13-26)33-19-35-17-16-34(18-23(35)22-11-6-8-14-31-22)24(36)20-9-4-5-10-21(20)27(28,29)30/h4-6,8-11,14,19,23H,2-3,7,12-13,15-18H2,1H3,(H,32,37)