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

Systemtic Name: methyl 5-ethyl-2-[[3-methoxypropyl-(2-oxidanyl-3-phenoxy-propyl)amino]methyl]-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 5-ethyl-2-[[(2-hydroxy-3-phenoxy-propyl)-(3-methoxypropyl)amino]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-ethyl-2-[[(2-hydroxy-3-phenoxypropyl)-(3-methoxypropyl)amino]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-[[(2-hydroxy-3-phenoxypropyl)-(3-methoxypropyl)amino]methyl]-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-ethyl-2-[[(2-hydroxy-3-phenoxy-propyl)-(3-methoxypropyl)amino]methyl]-4-keto-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C24H31N3O6S MolecularWeight: 489.58444

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)NC(=N2)CN(CCCOC)CC(COC3=CC=CC=C3)O)C(=O)OC

Isomeric SMILES

CCC1=C(SC2=C1C(=O)NC(=N2)CN(CCCOC)CC(COC3=CC=CC=C3)O)C(=O)OC

InChI

InChI=1S/C24H31N3O6S/c1-4-18-20-22(29)25-19(26-23(20)34-21(18)24(30)32-3)14-27(11-8-12-31-2)13-16(28)15-33-17-9-6-5-7-10-17/h5-7,9-10,16,28H,4,8,11-15H2,1-3H3,(H,25,26,29)