methyl N-[5-(ethoxymethyl)-2-methyl-pyrimidin-4-yl]-N'-ethyl-carbamimidothioate

Systemtic Name: methyl N-[5-(ethoxymethyl)-2-methyl-pyrimidin-4-yl]-N'-ethyl-carbamimidothioate Openeye Name: 1-[5-(ethoxymethyl)-2-methyl-pyrimidin-4-yl]-3-ethyl-2-methyl-isothiourea CAS Name: N-[5-(ethoxymethyl)-2-methyl-4-pyrimidinyl]-N'-ethylcarbamimidothioic acid methyl ester IUPAC Name: methyl N-[5-(ethoxymethyl)-2-methylpyrimidin-4-yl]-N'-ethylcarbamimidothioate Traditional Name: 1-[5-(ethoxymethyl)-2-methyl-pyrimidin-4-yl]-3-ethyl-2-methyl-isothiourea Formula: C12H20N4OS MolecularWeight: 268.3784

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C(NC1=NC(=NC=C1COCC)C)SC

Isomeric SMILES

CCN=C(NC1=NC(=NC=C1COCC)C)SC

InChI

InChI=1S/C12H20N4OS/c1-5-13-12(18-4)16-11-10(8-17-6-2)7-14-9(3)15-11/h7H,5-6,8H2,1-4H3,(H,13,14,15,16)