2-methyl-4-piperidin-1-yl-6-[[3-(trifluoromethyl)phenyl]methyl]-5H-pyrrolo[3,2-d]pyrimidine

Systemtic Name: 2-methyl-4-piperidin-1-yl-6-[[3-(trifluoromethyl)phenyl]methyl]-5H-pyrrolo[3,2-d]pyrimidine Openeye Name: 2-methyl-4-(1-piperidyl)-6-[[3-(trifluoromethyl)phenyl]methyl]-5H-pyrrolo[3,2-d]pyrimidine CAS Name: 2-methyl-4-(1-piperidinyl)-6-[[3-(trifluoromethyl)phenyl]methyl]-5H-pyrrolo[3,2-d]pyrimidine IUPAC Name: 2-methyl-4-piperidin-1-yl-6-[[3-(trifluoromethyl)phenyl]methyl]-5H-pyrrolo[3,2-d]pyrimidine Traditional Name: 2-methyl-4-piperidino-6-[3-(trifluoromethyl)benzyl]-5H-pyrrolo[3,2-d]pyrimidine Formula: C20H21F3N4 MolecularWeight: 374.40275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CCCCC3)NC(=C2)CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CCCCC3)NC(=C2)CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C20H21F3N4/c1-13-24-17-12-16(11-14-6-5-7-15(10-14)20(21,22)23)26-18(17)19(25-13)27-8-3-2-4-9-27/h5-7,10,12,26H,2-4,8-9,11H2,1H3