1-[2-azanyl-5-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]piperidin-4-one

Systemtic Name: 1-[2-azanyl-5-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]piperidin-4-one Openeye Name: 1-[2-amino-5-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]piperidin-4-one CAS Name: 1-[2-amino-5-[[4-(trifluoromethyl)phenyl]methyl]-4-pyrimidinyl]-4-piperidinone IUPAC Name: 1-[2-amino-5-[[4-(trifluoromethyl)phenyl]methyl]pyrimidin-4-yl]piperidin-4-one Traditional Name: 1-[2-amino-5-[4-(trifluoromethyl)benzyl]pyrimidin-4-yl]-4-piperidone Formula: C17H17F3N4O MolecularWeight: 350.33829

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C2=NC(=NC=C2CC3=CC=C(C=C3)C(F)(F)F)N

Isomeric SMILES

C1CN(CCC1=O)C2=NC(=NC=C2CC3=CC=C(C=C3)C(F)(F)F)N

InChI

InChI=1S/C17H17F3N4O/c18-17(19,20)13-3-1-11(2-4-13)9-12-10-22-16(21)23-15(12)24-7-5-14(25)6-8-24/h1-4,10H,5-9H2,(H2,21,22,23)