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

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide Openeye Name: N-(3,4-difluorophenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide CAS Name: N-(3,4-difluorophenyl)-4-methyl-2-(4-methyl-1-piperazinyl)-5-pyrimidinecarboxamide IUPAC Name: N-(3,4-difluorophenyl)-4-methyl-2-(4-methylpiperazin-1-yl)pyrimidine-5-carboxamide Traditional Name: N-(3,4-difluorophenyl)-4-methyl-2-(4-methylpiperazino)pyrimidine-5-carboxamide Formula: C17H19F2N5O MolecularWeight: 347.362466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)NC2=CC(=C(C=C2)F)F)N3CCN(CC3)C

Isomeric SMILES

CC1=NC(=NC=C1C(=O)NC2=CC(=C(C=C2)F)F)N3CCN(CC3)C

InChI

InChI=1S/C17H19F2N5O/c1-11-13(16(25)22-12-3-4-14(18)15(19)9-12)10-20-17(21-11)24-7-5-23(2)6-8-24/h3-4,9-10H,5-8H2,1-2H3,(H,22,25)