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

Systemtic Name: prop-2-enyl 2-[[furan-2-ylmethyl-(3-methyl-2-oxidanyl-butyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[2-furylmethyl-(2-hydroxy-3-methyl-butyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[2-furanylmethyl-(2-hydroxy-3-methylbutyl)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-3-methylbutyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[2-furfuryl-(2-hydroxy-3-methyl-butyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O5S/c1-5-8-30-22(28)19-14(4)18-20(27)23-17(24-21(18)31-19)12-25(11-16(26)13(2)3)10-15-7-6-9-29-15/h5-7,9,13,16,26H,1,8,10-12H2,2-4H3,(H,23,24,27)