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

Systemtic Name: propan-2-yl 2-[[furan-2-ylmethyl-(2-oxidanyl-3-phenyl-propyl)amino]methyl]-5-methyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isopropyl 2-[[2-furylmethyl-(2-hydroxy-3-phenyl-propyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 2-[[2-furanylmethyl-(2-hydroxy-3-phenylpropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[[furan-2-ylmethyl-(2-hydroxy-3-phenylpropyl)amino]methyl]-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 2-[[2-furfuryl-(2-hydroxy-3-phenyl-propyl)amino]methyl]-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid isopropyl ester Formula: C26H29N3O5S MolecularWeight: 495.59056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC3=CC=CO3)CC(CC4=CC=CC=C4)O)C(=O)OC(C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CN(CC3=CC=CO3)CC(CC4=CC=CC=C4)O)C(=O)OC(C)C

InChI

InChI=1S/C26H29N3O5S/c1-16(2)34-26(32)23-17(3)22-24(31)27-21(28-25(22)35-23)15-29(14-20-10-7-11-33-20)13-19(30)12-18-8-5-4-6-9-18/h4-11,16,19,30H,12-15H2,1-3H3,(H,27,28,31)