methyl 5-methyl-4-oxidanylidene-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-methyl-4-oxidanylidene-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-methyl-4-oxo-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-[(4-thieno[2,3-d]pyrimidinylthio)methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-oxo-2-(thieno[2,3-d]pyrimidin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[(thieno[2,3-d]pyrimidin-4-ylthio)methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C16H12N4O3S3 MolecularWeight: 404.48648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC=NC4=C3C=CS4)C(=O)OC

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC=NC4=C3C=CS4)C(=O)OC

InChI

InChI=1S/C16H12N4O3S3/c1-7-10-12(21)19-9(20-15(10)26-11(7)16(22)23-2)5-25-14-8-3-4-24-13(8)17-6-18-14/h3-4,6H,5H2,1-2H3,(H,19,20,21)