3-[[5-(4-fluorophenyl)pyrimidin-2-yl]amino]propanenitrile

Systemtic Name: 3-[[5-(4-fluorophenyl)pyrimidin-2-yl]amino]propanenitrile Openeye Name: 3-[[5-(4-fluorophenyl)pyrimidin-2-yl]amino]propanenitrile CAS Name: 3-[[5-(4-fluorophenyl)-2-pyrimidinyl]amino]propanenitrile IUPAC Name: 3-[[5-(4-fluorophenyl)pyrimidin-2-yl]amino]propanenitrile Traditional Name: 3-[[5-(4-fluorophenyl)pyrimidin-2-yl]amino]propionitrile Formula: C13H11FN4 MolecularWeight: 242.251643

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CN=C(N=C2)NCCC#N)F

Isomeric SMILES

C1=CC(=CC=C1C2=CN=C(N=C2)NCCC#N)F

InChI

InChI=1S/C13H11FN4/c14-12-4-2-10(3-5-12)11-8-17-13(18-9-11)16-7-1-6-15/h2-5,8-9H,1,7H2,(H,16,17,18)