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

Systemtic Name: 3-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]propanenitrile Openeye Name: 3-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]propanenitrile CAS Name: 3-[[5-(4-methoxyphenyl)-2-pyrimidinyl]amino]propanenitrile IUPAC Name: 3-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]propanenitrile Traditional Name: 3-[[5-(4-methoxyphenyl)pyrimidin-2-yl]amino]propionitrile Formula: C14H14N4O MolecularWeight: 254.28716

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN=C(N=C2)NCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN=C(N=C2)NCCC#N

InChI

InChI=1S/C14H14N4O/c1-19-13-5-3-11(4-6-13)12-9-17-14(18-10-12)16-8-2-7-15/h3-6,9-10H,2,8H2,1H3,(H,16,17,18)