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

Systemtic Name: prop-2-enyl 2-[[3-methoxypropyl(2-oxidanylpentyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[2-hydroxypentyl(3-methoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[2-hydroxypentyl(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-hydroxypentyl(3-methoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[2-hydroxypentyl(3-methoxypropyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H31N3O5S/c1-5-8-15(25)12-24(9-7-11-28-4)13-16-22-19(26)17-14(3)18(30-20(17)23-16)21(27)29-10-6-2/h6,15,25H,2,5,7-13H2,1,3-4H3,(H,22,23,26)