propan-2-yl 2-[[ethyl-(2-oxidanyl-2-phenyl-ethyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: propan-2-yl 2-[[ethyl-(2-oxidanyl-2-phenyl-ethyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 2-[[ethyl-(2-hydroxy-2-phenyl-ethyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[ethyl-(2-hydroxy-2-phenylethyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[ethyl-(2-hydroxy-2-phenylethyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[ethyl-(2-hydroxy-2-phenyl-ethyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC2=C(C(=C(S2)C(=O)OC(C)C)C)C(=O)N1)CC(C3=CC=CC=C3)O

Isomeric SMILES

CCN(CC1=NC2=C(C(=C(S2)C(=O)OC(C)C)C)C(=O)N1)CC(C3=CC=CC=C3)O

InChI

InChI=1S/C22H27N3O4S/c1-5-25(11-16(26)15-9-7-6-8-10-15)12-17-23-20(27)18-14(4)19(30-21(18)24-17)22(28)29-13(2)3/h6-10,13,16,26H,5,11-12H2,1-4H3,(H,23,24,27)