methyl 5-methyl-4-oxidanylidene-2-[[1-(phenylmethyl)imidazol-2-yl]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: methyl 5-methyl-4-oxidanylidene-2-[[1-(phenylmethyl)imidazol-2-yl]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 2-[(1-benzylimidazol-2-yl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-4-oxo-2-[[1-(phenylmethyl)-2-imidazolyl]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(1-benzylimidazol-2-yl)methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[(1-benzylimidazol-2-yl)methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C20H18N4O3S MolecularWeight: 394.44692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CC3=NC=CN3CC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CC3=NC=CN3CC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C20H18N4O3S/c1-12-16-18(25)22-14(23-19(16)28-17(12)20(26)27-2)10-15-21-8-9-24(15)11-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3,(H,22,23,25)