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

Systemtic Name: prop-2-enyl 2-[[3-methoxypropyl-(2-oxidanyl-3-phenyl-propyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[(2-hydroxy-3-phenyl-propyl)-(3-methoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[(2-hydroxy-3-phenylpropyl)-(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-hydroxy-3-phenylpropyl)-(3-methoxypropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[(2-hydroxy-3-phenyl-propyl)-(3-methoxypropyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CCCOC)CC(CC3=CC=CC=C3)O)C(=O)OCC=C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CCCOC)CC(CC3=CC=CC=C3)O)C(=O)OCC=C

InChI

InChI=1S/C25H31N3O5S/c1-4-12-33-25(31)22-17(2)21-23(30)26-20(27-24(21)34-22)16-28(11-8-13-32-3)15-19(29)14-18-9-6-5-7-10-18/h4-7,9-10,19,29H,1,8,11-16H2,2-3H3,(H,26,27,30)