ethyl 3-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: ethyl 3-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: ethyl 3-[2-(1,1-diethylprop-2-ynylamino)-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-(3-ethylpent-1-yn-3-ylamino)-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-(1,1-diethylprop-2-ynylamino)-2-keto-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid ethyl ester Formula: C19H23N3O4S MolecularWeight: 389.46862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)OCC)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)CN1C=NC2=C(C1=O)C(=C(S2)C(=O)OCC)C

InChI

InChI=1S/C19H23N3O4S/c1-6-19(7-2,8-3)21-13(23)10-22-11-20-16-14(17(22)24)12(5)15(27-16)18(25)26-9-4/h1,11H,7-10H2,2-5H3,(H,21,23)