(E)-4-[2,4-bis(azanyl)pyrimidin-5-yl]but-2-enoic acid

Systemtic Name: (E)-4-[2,4-bis(azanyl)pyrimidin-5-yl]but-2-enoic acid Openeye Name: (E)-4-(2,4-diaminopyrimidin-5-yl)but-2-enoic acid CAS Name: (E)-4-(2,4-diamino-5-pyrimidinyl)-2-butenoic acid IUPAC Name: (E)-4-(2,4-diaminopyrimidin-5-yl)but-2-enoic acid Traditional Name: (E)-4-(2,4-diaminopyrimidin-5-yl)but-2-enoic acid Formula: C8H10N4O2 MolecularWeight: 194.1906

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NC(=N1)N)N)CC=CC(=O)O

Isomeric SMILES

C1=C(C(=NC(=N1)N)N)C/C=C/C(=O)O

InChI

InChI=1S/C8H10N4O2/c9-7-5(2-1-3-6(13)14)4-11-8(10)12-7/h1,3-4H,2H2,(H,13,14)(H4,9,10,11,12)/b3-1+