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

Systemtic Name: methyl 2-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-5-(2-methoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-5-(2-methoxy-2-oxo-ethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[(1-cyclopropyl-2-imidazolyl)thio]methyl]-5-(2-methoxy-2-oxoethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(1-cyclopropylimidazol-2-yl)sulfanylmethyl]-5-(2-methoxy-2-oxoethyl)-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[(1-cyclopropylimidazol-2-yl)thio]methyl]-4-keto-5-(2-keto-2-methoxy-ethyl)-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C18H18N4O5S2 MolecularWeight: 434.48932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC=CN3C4CC4)C(=O)OC

Isomeric SMILES

COC(=O)CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC=CN3C4CC4)C(=O)OC

InChI

InChI=1S/C18H18N4O5S2/c1-26-12(23)7-10-13-15(24)20-11(21-16(13)29-14(10)17(25)27-2)8-28-18-19-5-6-22(18)9-3-4-9/h5-6,9H,3-4,7-8H2,1-2H3,(H,20,21,24)