ethyl 3-methyl-5-(2-pyrimidin-2-ylsulfanylethanoylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-5-(2-pyrimidin-2-ylsulfanylethanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-5-[(2-pyrimidin-2-ylsulfanylacetyl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-5-[[1-oxo-2-(2-pyrimidinylthio)ethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[(2-pyrimidin-2-ylsulfanylacetyl)amino]thiophene-2-carboxylate Traditional Name: 3-methyl-5-[[2-(2-pyrimidylthio)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C14H15N3O3S2 MolecularWeight: 337.4172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)CSC2=NC=CC=N2)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)CSC2=NC=CC=N2)C

InChI

InChI=1S/C14H15N3O3S2/c1-3-20-13(19)12-9(2)7-11(22-12)17-10(18)8-21-14-15-5-4-6-16-14/h4-7H,3,8H2,1-2H3,(H,17,18)