1-[(E)-2-[4-(methoxymethyl)-6-(2-oxidanylidenepropyl)pyrimidin-2-yl]ethylideneamino]urea

Systemtic Name: 1-[(E)-2-[4-(methoxymethyl)-6-(2-oxidanylidenepropyl)pyrimidin-2-yl]ethylideneamino]urea Openeye Name: [(E)-2-[4-acetonyl-6-(methoxymethyl)pyrimidin-2-yl]ethylideneamino]urea CAS Name: [(E)-2-[4-(methoxymethyl)-6-(2-oxopropyl)-2-pyrimidinyl]ethylideneamino]urea IUPAC Name: [(E)-2-[4-(methoxymethyl)-6-(2-oxopropyl)pyrimidin-2-yl]ethylideneamino]urea Traditional Name: [(E)-2-[4-acetonyl-6-(methoxymethyl)pyrimidin-2-yl]ethylideneamino]urea Formula: C12H17N5O3 MolecularWeight: 279.29508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=CC(=NC(=N1)CC=NNC(=O)N)COC

Isomeric SMILES

CC(=O)CC1=CC(=NC(=N1)C/C=N/NC(=O)N)COC

InChI

InChI=1S/C12H17N5O3/c1-8(18)5-9-6-10(7-20-2)16-11(15-9)3-4-14-17-12(13)19/h4,6H,3,5,7H2,1-2H3,(H3,13,17,19)/b14-4+