methyl N-[1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N'-prop-2-enyl-carbamimidothioate hydroiodide

Systemtic Name: methyl N-[1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N'-prop-2-enyl-carbamimidothioate hydroiodide Openeye Name: 3-allyl-1-(1,3-dimethyl-2,4-dioxo-pyrimidin-5-yl)-2-methyl-isothiourea hydroiodide CAS Name: N-(1,3-dimethyl-2,4-dioxo-5-pyrimidinyl)-N'-prop-2-enylcarbamimidothioic acid methyl ester hydroiodide IUPAC Name: methyl N-(1,3-dimethyl-2,4-dioxopyrimidin-5-yl)-N'-prop-2-enylcarbamimidothioate hydroiodide Traditional Name: 3-allyl-1-(2,4-diketo-1,3-dimethyl-pyrimidin-5-yl)-2-methyl-isothiourea hydroiodide Formula: C11H17IN4O2S MolecularWeight: 396.24775

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N(C1=O)C)NC(=NCC=C)SC.I

Isomeric SMILES

CN1C=C(C(=O)N(C1=O)C)NC(=NCC=C)SC.I

InChI

InChI=1S/C11H16N4O2S.HI/c1-5-6-12-10(18-4)13-8-7-14(2)11(17)15(3)9(8)16;/h5,7H,1,6H2,2-4H3,(H,12,13);1H