N-[3,4-bis(fluoranyl)phenyl]-4-methyl-2-pyrrolidin-1-yl-pyrimidine-5-carboxamide

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-4-methyl-2-pyrrolidin-1-yl-pyrimidine-5-carboxamide Openeye Name: N-(3,4-difluorophenyl)-4-methyl-2-pyrrolidin-1-yl-pyrimidine-5-carboxamide CAS Name: N-(3,4-difluorophenyl)-4-methyl-2-(1-pyrrolidinyl)-5-pyrimidinecarboxamide IUPAC Name: N-(3,4-difluorophenyl)-4-methyl-2-pyrrolidin-1-ylpyrimidine-5-carboxamide Traditional Name: N-(3,4-difluorophenyl)-4-methyl-2-pyrrolidino-pyrimidine-5-carboxamide Formula: C16H16F2N4O MolecularWeight: 318.321246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC(=C(C=C2)F)F)N3CCCC3

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC(=C(C=C2)F)F)N3CCCC3

InChI

InChI=1S/C16H16F2N4O/c1-10-12(9-19-16(20-10)22-6-2-3-7-22)15(23)21-11-4-5-13(17)14(18)8-11/h4-5,8-9H,2-3,6-7H2,1H3,(H,21,23)