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

Systemtic Name: propan-2-yl 2-[[ethyl-(2-oxidanyl-3-prop-2-enoxy-propyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 2-[[(3-allyloxy-2-hydroxy-propyl)-ethyl-amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[ethyl-(2-hydroxy-3-prop-2-enoxypropyl)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-3-prop-2-enoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[(3-allyloxy-2-hydroxy-propyl)-ethyl-amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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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(COCC=C)O

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O5S/c1-6-8-27-11-14(24)9-23(7-2)10-15-21-18(25)16-13(5)17(29-19(16)22-15)20(26)28-12(3)4/h6,12,14,24H,1,7-11H2,2-5H3,(H,21,22,25)