2-methylpropyl 4-[(2,5-diethoxy-4-morpholin-4-yl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methylpropyl 4-[(2,5-diethoxy-4-morpholin-4-yl-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 4-(2,5-diethoxy-4-morpholino-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-[2,5-diethoxy-4-(4-morpholinyl)anilino]-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-(2,5-diethoxy-4-morpholin-4-ylanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(2,5-diethoxy-4-morpholino-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C26H34N4O5S MolecularWeight: 514.63696

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC3=C4C(=C(SC4=NC=N3)C(=O)OCC(C)C)C

Isomeric SMILES

CCOC1=CC(=C(C=C1N2CCOCC2)OCC)NC3=C4C(=C(SC4=NC=N3)C(=O)OCC(C)C)C

InChI

InChI=1S/C26H34N4O5S/c1-6-33-20-13-19(30-8-10-32-11-9-30)21(34-7-2)12-18(20)29-24-22-17(5)23(26(31)35-14-16(3)4)36-25(22)28-15-27-24/h12-13,15-16H,6-11,14H2,1-5H3,(H,27,28,29)