2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[2,4-bis(fluoranyl)phenyl]propanamide

Systemtic Name: 2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-[2,4-bis(fluoranyl)phenyl]propanamide Openeye Name: 2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2,4-difluorophenyl)propanamide CAS Name: 2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(2,4-difluorophenyl)propanamide IUPAC Name: 2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(2,4-difluorophenyl)propanamide Traditional Name: 2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(2,4-difluorophenyl)propionamide Formula: C14H11F2N5OS MolecularWeight: 335.331846

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)F)F)SC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

CC(C(=O)NC1=C(C=C(C=C1)F)F)SC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C14H11F2N5OS/c1-7(23-14-19-6-8(5-17)12(18)21-14)13(22)20-11-3-2-9(15)4-10(11)16/h2-4,6-7H,1H3,(H,20,22)(H2,18,19,21)