dimethyl 5-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-[2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylethanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[(4,6-diamino-2-pyrimidinyl)thio]-1-oxoethyl]amino]-3-methylthiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(4,6-diaminopyrimidin-2-yl)sulfanylacetyl]amino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-[(4,6-diaminopyrimidin-2-yl)thio]acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H17N5O5S2 MolecularWeight: 411.45598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC(=CC(=N2)N)N)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC(=CC(=N2)N)N)C(=O)OC

InChI

InChI=1S/C15H17N5O5S2/c1-6-10(13(22)24-2)12(27-11(6)14(23)25-3)20-9(21)5-26-15-18-7(16)4-8(17)19-15/h4H,5H2,1-3H3,(H,20,21)(H4,16,17,18,19)