prop-2-enyl 2-[[furan-2-ylmethyl-(2-methyl-2-oxidanyl-propyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: prop-2-enyl 2-[[furan-2-ylmethyl-(2-methyl-2-oxidanyl-propyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[2-furylmethyl-(2-hydroxy-2-methyl-propyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[2-furanylmethyl-(2-hydroxy-2-methylpropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[[furan-2-ylmethyl-(2-hydroxy-2-methylpropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[2-furfuryl-(2-hydroxy-2-methyl-propyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC3=CC=CO3)CC(C)(C)O)C(=O)OCC=C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC3=CC=CO3)CC(C)(C)O)C(=O)OCC=C

InChI

InChI=1S/C21H25N3O5S/c1-5-8-29-20(26)17-13(2)16-18(25)22-15(23-19(16)30-17)11-24(12-21(3,4)27)10-14-7-6-9-28-14/h5-7,9,27H,1,8,10-12H2,2-4H3,(H,22,23,25)