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

Systemtic Name: prop-2-enyl 5-methyl-2-[[2-oxidanylhex-5-enyl(propyl)amino]methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[2-hydroxyhex-5-enyl(propyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[2-hydroxyhex-5-enyl(propyl)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-hydroxyhex-5-enyl(propyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[2-hydroxyhex-5-enyl(propyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC2=C(C(=C(S2)C(=O)OCC=C)C)C(=O)N1)CC(CCC=C)O

Isomeric SMILES

CCCN(CC1=NC2=C(C(=C(S2)C(=O)OCC=C)C)C(=O)N1)CC(CCC=C)O

InChI

InChI=1S/C21H29N3O4S/c1-5-8-9-15(25)12-24(10-6-2)13-16-22-19(26)17-14(4)18(29-20(17)23-16)21(27)28-11-7-3/h5,7,15,25H,1,3,6,8-13H2,2,4H3,(H,22,23,26)