2-[5-(cyanomethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine

Systemtic Name: 2-[5-(cyanomethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine Openeye Name: 2-[5-(cyanomethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine CAS Name: 2-[5-(cyanomethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine IUPAC Name: 2-[5-(cyanomethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine Traditional Name: 2-[5-(cyanomethyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]-1-(4-fluorophenyl)guanidine Formula: C14H13FN6O MolecularWeight: 300.291023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)N=C(N)NC2=CC=C(C=C2)F)CC#N

Isomeric SMILES

CC1=C(C(=O)N=C(N1)/N=C(/N)\NC2=CC=C(C=C2)F)CC#N

InChI

InChI=1S/C14H13FN6O/c1-8-11(6-7-16)12(22)20-14(18-8)21-13(17)19-10-4-2-9(15)3-5-10/h2-5H,6H2,1H3,(H4,17,18,19,20,21,22)