1-[7-(2,6-dimethoxypyrimidin-4-yl)hept-1-en-6-yn-4-yl]urea

Systemtic Name: 1-[7-(2,6-dimethoxypyrimidin-4-yl)hept-1-en-6-yn-4-yl]urea Openeye Name: 1-[3-(2,6-dimethoxypyrimidin-4-yl)prop-2-ynyl]but-3-enylurea CAS Name: 7-(2,6-dimethoxy-4-pyrimidinyl)hept-1-en-6-yn-4-ylurea IUPAC Name: 7-(2,6-dimethoxypyrimidin-4-yl)hept-1-en-6-yn-4-ylurea Traditional Name: 1-[3-(2,6-dimethoxypyrimidin-4-yl)prop-2-ynyl]but-3-enylurea Formula: C14H18N4O3 MolecularWeight: 290.31772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)C#CCC(CC=C)NC(=O)N)OC

Isomeric SMILES

COC1=NC(=NC(=C1)C#CCC(CC=C)NC(=O)N)OC

InChI

InChI=1S/C14H18N4O3/c1-4-6-10(16-13(15)19)7-5-8-11-9-12(20-2)18-14(17-11)21-3/h4,9-10H,1,6-7H2,2-3H3,(H3,15,16,19)