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

Systemtic Name: 2-[5-(2-cyanoethyl)-6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl]-1-phenyl-guanidine Openeye Name: 2-[5-(2-cyanoethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-phenyl-guanidine CAS Name: 2-[5-(2-cyanoethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-phenylguanidine IUPAC Name: 2-[5-(2-cyanoethyl)-6-methyl-4-oxo-1H-pyrimidin-2-yl]-1-phenylguanidine Traditional Name: 2-[5-(2-cyanoethyl)-4-keto-6-methyl-1H-pyrimidin-2-yl]-1-phenyl-guanidine Formula: C15H16N6O MolecularWeight: 296.32714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N6O/c1-10-12(8-5-9-16)13(22)20-15(18-10)21-14(17)19-11-6-3-2-4-7-11/h2-4,6-7H,5,8H2,1H3,(H4,17,18,19,20,21,22)