prop-2-enyl 2-[[cyclopropyl-(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-[[cyclopropyl-(2-oxidanyl-3-phenyl-propyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[cyclopropyl-(2-hydroxy-3-phenyl-propyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[cyclopropyl-(2-hydroxy-3-phenylpropyl)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-[[cyclopropyl-(2-hydroxy-3-phenylpropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[cyclopropyl-(2-hydroxy-3-phenyl-propyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C24H27N3O4S MolecularWeight: 453.55388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(CC3=CC=CC=C3)O)C4CC4)C(=O)OCC=C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC(CC3=CC=CC=C3)O)C4CC4)C(=O)OCC=C

InChI

InChI=1S/C24H27N3O4S/c1-3-11-31-24(30)21-15(2)20-22(29)25-19(26-23(20)32-21)14-27(17-9-10-17)13-18(28)12-16-7-5-4-6-8-16/h3-8,17-18,28H,1,9-14H2,2H3,(H,25,26,29)