diethyl 3-methyl-5-[2-(5-methyl-4-oxidanylidene-6-phenethyloxycarbonyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 3-methyl-5-[2-(5-methyl-4-oxidanylidene-6-phenethyloxycarbonyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: diethyl 3-methyl-5-[[2-(5-methyl-4-oxo-6-phenethyloxycarbonyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-[5-methyl-4-oxo-6-[oxo(phenethyloxy)methyl]-3-thieno[2,3-d]pyrimidinyl]-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methyl-5-[[2-(5-methyl-4-oxo-6-phenethyloxycarbonylthieno[2,3-d]pyrimidin-3-yl)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 5-[[2-(4-keto-5-methyl-6-phenethyloxycarbonyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C29H29N3O8S2 MolecularWeight: 611.68586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)OCCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CN2C=NC3=C(C2=O)C(=C(S3)C(=O)OCCC4=CC=CC=C4)C

InChI

InChI=1S/C29H29N3O8S2/c1-5-38-27(35)21-17(4)23(28(36)39-6-2)42-25(21)31-19(33)14-32-15-30-24-20(26(32)34)16(3)22(41-24)29(37)40-13-12-18-10-8-7-9-11-18/h7-11,15H,5-6,12-14H2,1-4H3,(H,31,33)