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

Systemtic Name: prop-2-enyl 5-methyl-4-oxidanylidene-2-[[(2-oxidanyl-3-phenyl-propyl)-propan-2-yl-amino]methyl]-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[(2-hydroxy-3-phenyl-propyl)-isopropyl-amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[(2-hydroxy-3-phenylpropyl)-propan-2-ylamino]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)-propan-2-ylamino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[(2-hydroxy-3-phenyl-propyl)-isopropyl-amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid allyl ester Formula: C24H29N3O4S MolecularWeight: 455.56976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O4S/c1-5-11-31-24(30)21-16(4)20-22(29)25-19(26-23(20)32-21)14-27(15(2)3)13-18(28)12-17-9-7-6-8-10-17/h5-10,15,18,28H,1,11-14H2,2-4H3,(H,25,26,29)