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

Systemtic Name: prop-2-enyl 5-methyl-4-oxidanylidene-2-[[(2-oxidanyl-2-phenyl-ethyl)-propyl-amino]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[(2-hydroxy-2-phenyl-ethyl)-propyl-amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[(2-hydroxy-2-phenylethyl)-propylamino]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-hydroxy-2-phenylethyl)-propylamino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[(2-hydroxy-2-phenyl-ethyl)-propyl-amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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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(C3=CC=CC=C3)O

Isomeric SMILES

CCCN(CC1=NC2=C(C(=C(S2)C(=O)OCC=C)C)C(=O)N1)CC(C3=CC=CC=C3)O

InChI

InChI=1S/C23H27N3O4S/c1-4-11-26(13-17(27)16-9-7-6-8-10-16)14-18-24-21(28)19-15(3)20(31-22(19)25-18)23(29)30-12-5-2/h5-10,17,27H,2,4,11-14H2,1,3H3,(H,24,25,28)