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

Systemtic Name: 2-[5-(cyanomethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]-1-phenyl-guanidine Openeye Name: 2-[5-(cyanomethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-phenyl-guanidine CAS Name: 2-[5-(cyanomethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-phenylguanidine IUPAC Name: 2-[5-(cyanomethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-phenylguanidine Traditional Name: 2-[5-(cyanomethyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]-1-phenyl-guanidine Formula: C14H14N6O MolecularWeight: 282.30056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N6O/c1-9-11(7-8-15)12(21)19-14(17-9)20-13(16)18-10-5-3-2-4-6-10/h2-6H,7H2,1H3,(H4,16,17,18,19,20,21)