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

Systemtic Name: methyl 4-[(4-benzamido-2,5-diethoxy-phenyl)amino]-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: methyl 4-(4-benzamido-2,5-diethoxy-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 4-(4-benzamido-2,5-diethoxyanilino)-5-methyl-6-thieno[2,3-d]pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-benzamido-2,5-diethoxyanilino)-5-methylthieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 4-(4-benzamido-2,5-diethoxy-anilino)-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid methyl ester Formula: C26H26N4O5S MolecularWeight: 506.57344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1NC2=C3C(=C(SC3=NC=N2)C(=O)OC)C)OCC)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC(=C(C=C1NC2=C3C(=C(SC3=NC=N2)C(=O)OC)C)OCC)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H26N4O5S/c1-5-34-19-13-18(30-24(31)16-10-8-7-9-11-16)20(35-6-2)12-17(19)29-23-21-15(3)22(26(32)33-4)36-25(21)28-14-27-23/h7-14H,5-6H2,1-4H3,(H,30,31)(H,27,28,29)