3-[[5-chloranyl-6-(1-fluoroethyl)pyrimidin-4-yl]amino]benzenecarbonitrile

Systemtic Name: 3-[[5-chloranyl-6-(1-fluoroethyl)pyrimidin-4-yl]amino]benzenecarbonitrile Openeye Name: 3-[[5-chloro-6-(1-fluoroethyl)pyrimidin-4-yl]amino]benzonitrile CAS Name: 3-[[5-chloro-6-(1-fluoroethyl)-4-pyrimidinyl]amino]benzonitrile IUPAC Name: 3-[[5-chloro-6-(1-fluoroethyl)pyrimidin-4-yl]amino]benzonitrile Traditional Name: 3-[[5-chloro-6-(1-fluoroethyl)pyrimidin-4-yl]amino]benzonitrile Formula: C13H10ClFN4 MolecularWeight: 276.696703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=NC=N1)NC2=CC=CC(=C2)C#N)Cl)F

Isomeric SMILES

CC(C1=C(C(=NC=N1)NC2=CC=CC(=C2)C#N)Cl)F

InChI

InChI=1S/C13H10ClFN4/c1-8(15)12-11(14)13(18-7-17-12)19-10-4-2-3-9(5-10)6-16/h2-5,7-8H,1H3,(H,17,18,19)