prop-2-enyl 2-[[3-methoxypropyl(2-oxidanylbutyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: prop-2-enyl 2-[[3-methoxypropyl(2-oxidanylbutyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[2-hydroxybutyl(3-methoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[2-hydroxybutyl(3-methoxypropyl)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-[[2-hydroxybutyl(3-methoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[2-hydroxybutyl(3-methoxypropyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(CCCOC)CC1=NC2=C(C(=C(S2)C(=O)OCC=C)C)C(=O)N1)O

Isomeric SMILES

CCC(CN(CCCOC)CC1=NC2=C(C(=C(S2)C(=O)OCC=C)C)C(=O)N1)O

InChI

InChI=1S/C20H29N3O5S/c1-5-9-28-20(26)17-13(3)16-18(25)21-15(22-19(16)29-17)12-23(8-7-10-27-4)11-14(24)6-2/h5,14,24H,1,6-12H2,2-4H3,(H,21,22,25)