4-[[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methyl-ethyl-amino]methyl]-3-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[[[1,3-dimethyl-2,6-bis(oxidanylidene)pyrimidin-4-yl]methyl-ethyl-amino]methyl]-3-fluoranyl-benzenecarbonitrile Openeye Name: 4-[[(1,3-dimethyl-2,6-dioxo-pyrimidin-4-yl)methyl-ethyl-amino]methyl]-3-fluoro-benzonitrile CAS Name: 4-[[(1,3-dimethyl-2,6-dioxo-4-pyrimidinyl)methyl-ethylamino]methyl]-3-fluorobenzonitrile IUPAC Name: 4-[[(1,3-dimethyl-2,6-dioxopyrimidin-4-yl)methyl-ethylamino]methyl]-3-fluorobenzonitrile Traditional Name: 4-[[(2,6-diketo-1,3-dimethyl-pyrimidin-4-yl)methyl-ethyl-amino]methyl]-3-fluoro-benzonitrile Formula: C17H19FN4O2 MolecularWeight: 330.356763

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=C(C=C1)C#N)F)CC2=CC(=O)N(C(=O)N2C)C

Isomeric SMILES

CCN(CC1=C(C=C(C=C1)C#N)F)CC2=CC(=O)N(C(=O)N2C)C

InChI

InChI=1S/C17H19FN4O2/c1-4-22(10-13-6-5-12(9-19)7-15(13)18)11-14-8-16(23)21(3)17(24)20(14)2/h5-8H,4,10-11H2,1-3H3