dimethyl 5-[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[1-oxo-2-[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]ethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)thio]acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C24H19N3O5S2 MolecularWeight: 493.55476

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)NC(=O)CSC2=NC=NC3=C2C=C(S3)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C24H19N3O5S2/c1-31-23(29)15-8-16(24(30)32-2)10-17(9-15)27-20(28)12-33-21-18-11-19(14-6-4-3-5-7-14)34-22(18)26-13-25-21/h3-11,13H,12H2,1-2H3,(H,27,28)