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

Systemtic Name: prop-2-enyl 2-[[cyclohexyl(2-oxidanylpentyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[cyclohexyl(2-hydroxypentyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[cyclohexyl(2-hydroxypentyl)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-[[cyclohexyl(2-hydroxypentyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[cyclohexyl(2-hydroxypentyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C23H33N3O4S MolecularWeight: 447.59082

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CN(CC1=NC2=C(C(=C(S2)C(=O)OCC=C)C)C(=O)N1)C3CCCCC3)O

Isomeric SMILES

CCCC(CN(CC1=NC2=C(C(=C(S2)C(=O)OCC=C)C)C(=O)N1)C3CCCCC3)O

InChI

InChI=1S/C23H33N3O4S/c1-4-9-17(27)13-26(16-10-7-6-8-11-16)14-18-24-21(28)19-15(3)20(31-22(19)25-18)23(29)30-12-5-2/h5,16-17,27H,2,4,6-14H2,1,3H3,(H,24,25,28)