2-methoxyethyl 5-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methoxyethyl 5-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: 2-methoxyethyl 5-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 5-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-keto-5-methyl-2-[[methyl(2-phenoxyethyl)amino]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid 2-methoxyethyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(C)CCOC3=CC=CC=C3)C(=O)OCCOC

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(C)CCOC3=CC=CC=C3)C(=O)OCCOC

InChI

InChI=1S/C21H25N3O5S/c1-14-17-19(25)22-16(13-24(2)9-10-28-15-7-5-4-6-8-15)23-20(17)30-18(14)21(26)29-12-11-27-3/h4-8H,9-13H2,1-3H3,(H,22,23,25)