1-(6-piperazin-1-ylpyridin-3-yl)-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-(6-piperazin-1-ylpyridin-3-yl)-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-(6-piperazin-1-yl-3-pyridyl)-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-[6-(1-piperazinyl)-3-pyridinyl]-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-(6-piperazin-1-ylpyridin-3-yl)-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-(6-piperazino-3-pyridyl)-3-[4-(trifluoromethyl)phenyl]urea Formula: C17H18F3N5O MolecularWeight: 365.35293

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1CN(CCN1)C2=NC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H18F3N5O/c18-17(19,20)12-1-3-13(4-2-12)23-16(26)24-14-5-6-15(22-11-14)25-9-7-21-8-10-25/h1-6,11,21H,7-10H2,(H2,23,24,26)