5-[2-(4-oxidanylidene-3,5-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxamide

Systemtic Name: 5-[2-(4-oxidanylidene-3,5-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylethanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[2-(4-oxo-3,5-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[1-oxo-2-[(4-oxo-3,5-diphenyl-2-thieno[2,3-d]pyrimidinyl)thio]ethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[2-(4-oxo-3,5-diphenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[2-[(4-keto-3,5-diphenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetyl]amino]isophthalamide Formula: C28H21N5O4S2 MolecularWeight: 555.62744

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCC(=O)NC4=CC(=CC(=C4)C(=O)N)C(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C28H21N5O4S2/c29-24(35)17-11-18(25(30)36)13-19(12-17)31-22(34)15-39-28-32-26-23(21(14-38-26)16-7-3-1-4-8-16)27(37)33(28)20-9-5-2-6-10-20/h1-14H,15H2,(H2,29,35)(H2,30,36)(H,31,34)