methyl 5-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-2-(pyrrolidin-1-ylcarbothioylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-2-(pyrrolidin-1-ylcarbothioylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-(2-methoxy-2-oxo-ethyl)-4-oxo-2-(pyrrolidine-1-carbothioylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-(2-methoxy-2-oxoethyl)-4-oxo-2-[[[1-pyrrolidinyl(sulfanylidene)methyl]thio]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-(2-methoxy-2-oxoethyl)-4-oxo-2-(pyrrolidine-1-carbothioylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-(2-keto-2-methoxy-ethyl)-2-[(pyrrolidine-1-carbothioylthio)methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C17H19N3O5S3 MolecularWeight: 441.54486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(SC2=C1C(=O)NC(=N2)CSC(=S)N3CCCC3)C(=O)OC

Isomeric SMILES

COC(=O)CC1=C(SC2=C1C(=O)NC(=N2)CSC(=S)N3CCCC3)C(=O)OC

InChI

InChI=1S/C17H19N3O5S3/c1-24-11(21)7-9-12-14(22)18-10(8-27-17(26)20-5-3-4-6-20)19-15(12)28-13(9)16(23)25-2/h3-8H2,1-2H3,(H,18,19,22)