(5R,7S)-N-butyl-3-chloranyl-5-(furan-2-yl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide

Systemtic Name: (5R,7S)-N-butyl-3-chloranyl-5-(furan-2-yl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide Openeye Name: (5R,7S)-N-butyl-3-chloro-5-(2-furyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide CAS Name: (5R,7S)-N-butyl-3-chloro-5-(2-furanyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide IUPAC Name: (5R,7S)-N-butyl-3-chloro-5-(furan-2-yl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide Traditional Name: (5R,7S)-N-butyl-3-chloro-5-(2-furyl)-7-(trifluoromethyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide Formula: C16H18ClF3N4O2 MolecularWeight: 390.78793

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=C(C2=NC(CC(N2N1)C(F)(F)F)C3=CC=CO3)Cl

Isomeric SMILES

CCCCNC(=O)C1=C(C2=N[C@H](C[C@H](N2N1)C(F)(F)F)C3=CC=CO3)Cl

InChI

InChI=1S/C16H18ClF3N4O2/c1-2-3-6-21-15(25)13-12(17)14-22-9(10-5-4-7-26-10)8-11(16(18,19)20)24(14)23-13/h4-5,7,9,11,23H,2-3,6,8H2,1H3,(H,21,25)/t9-,11+/m1/s1