N-[4-chloranyl-3-(trifluoromethyl)phenyl]-1-pteridin-4-yl-piperidine-4-carboxamide

Systemtic Name: N-[4-chloranyl-3-(trifluoromethyl)phenyl]-1-pteridin-4-yl-piperidine-4-carboxamide Openeye Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-pteridin-4-yl-piperidine-4-carboxamide CAS Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-(4-pteridinyl)-4-piperidinecarboxamide IUPAC Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-pteridin-4-ylpiperidine-4-carboxamide Traditional Name: N-[4-chloro-3-(trifluoromethyl)phenyl]-1-pteridin-4-yl-isonipecotamide Formula: C19H16ClF3N6O MolecularWeight: 436.81815

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C3=NC=NC4=NC=CN=C43

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)C3=NC=NC4=NC=CN=C43

InChI

InChI=1S/C19H16ClF3N6O/c20-14-2-1-12(9-13(14)19(21,22)23)28-18(30)11-3-7-29(8-4-11)17-15-16(26-10-27-17)25-6-5-24-15/h1-2,5-6,9-11H,3-4,7-8H2,(H,28,30)