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

Systemtic Name: 5-[2-(4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)ethanoylamino]benzene-1,3-dicarboxamide Openeye Name: 5-[[2-(4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzene-1,3-dicarboxamide CAS Name: 5-[[1-oxo-2-(4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)ethyl]amino]benzene-1,3-dicarboxamide IUPAC Name: 5-[[2-(4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)acetyl]amino]benzene-1,3-dicarboxamide Traditional Name: 5-[[2-(4-keto-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)acetyl]amino]isophthalamide Formula: C22H17N5O4S MolecularWeight: 447.46648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N5O4S/c23-19(29)13-6-14(20(24)30)8-15(7-13)26-17(28)9-27-11-25-21-18(22(27)31)16(10-32-21)12-4-2-1-3-5-12/h1-8,10-11H,9H2,(H2,23,29)(H2,24,30)(H,26,28)