phenyl N'-(2-azanylpyrimidin-5-yl)-N-cyano-carbamimidate

Systemtic Name: phenyl N'-(2-azanylpyrimidin-5-yl)-N-cyano-carbamimidate Openeye Name: 3-(2-aminopyrimidin-5-yl)-1-cyano-2-phenyl-isourea CAS Name: N'-(2-amino-5-pyrimidinyl)-N-cyanocarbamimidic acid phenyl ester IUPAC Name: phenyl N'-(2-aminopyrimidin-5-yl)-N-cyanocarbamimidate Traditional Name: 3-(2-aminopyrimidin-5-yl)-1-cyano-2-phenyl-isourea Formula: C12H10N6O MolecularWeight: 254.2474

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=NC2=CN=C(N=C2)N)NC#N

Isomeric SMILES

C1=CC=C(C=C1)OC(=NC2=CN=C(N=C2)N)NC#N

InChI

InChI=1S/C12H10N6O/c13-8-17-12(19-10-4-2-1-3-5-10)18-9-6-15-11(14)16-7-9/h1-7H,(H,17,18)(H2,14,15,16)