dimethyl 3-methyl-5-(2-pyrimidin-2-ylsulfanylethanoylamino)thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-methyl-5-(2-pyrimidin-2-ylsulfanylethanoylamino)thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-methyl-5-[(2-pyrimidin-2-ylsulfanylacetyl)amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-methyl-5-[(2-pyrimidin-2-ylsulfanylacetyl)amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(2-pyrimidylthio)acetyl]amino]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C15H15N3O5S2 MolecularWeight: 381.4267

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O5S2/c1-8-10(13(20)22-2)12(25-11(8)14(21)23-3)18-9(19)7-24-15-16-5-4-6-17-15/h4-6H,7H2,1-3H3,(H,18,19)