ethyl 2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-5-[(3-ethoxy-3-oxidanylidene-propanoyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-(2-ethoxy-2-oxidanylidene-ethyl)sulfanyl-5-[(3-ethoxy-3-oxidanylidene-propanoyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 2-(2-ethoxy-2-oxo-ethyl)sulfanyl-5-[(3-ethoxy-3-oxo-propanoyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-[(3-ethoxy-1,3-dioxopropyl)amino]-2-[(2-ethoxy-2-oxoethyl)thio]-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(2-ethoxy-2-oxoethyl)sulfanyl-5-[(3-ethoxy-3-oxopropanoyl)amino]thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(2-ethoxy-2-keto-ethyl)thio]-5-[(3-ethoxy-3-keto-propanoyl)amino]thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H21N3O7S2 MolecularWeight: 455.50524

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)NC1=C(SC2=NC(=NC=C12)SCC(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)CC(=O)NC1=C(SC2=NC(=NC=C12)SCC(=O)OCC)C(=O)OCC

InChI

InChI=1S/C18H21N3O7S2/c1-4-26-12(23)7-11(22)20-14-10-8-19-18(29-9-13(24)27-5-2)21-16(10)30-15(14)17(25)28-6-3/h8H,4-7,9H2,1-3H3,(H,20,22)