N-[2,5-dimethoxy-4-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)phenyl]benzamide

Systemtic Name: N-[2,5-dimethoxy-4-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)phenyl]benzamide Openeye Name: N-[2,5-dimethoxy-4-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]phenyl]benzamide CAS Name: N-[2,5-dimethoxy-4-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]amino]phenyl]benzamide IUPAC Name: N-[2,5-dimethoxy-4-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]phenyl]benzamide Traditional Name: N-[2,5-dimethoxy-4-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]amino]phenyl]benzamide Formula: C23H20N4O4S2 MolecularWeight: 480.5593

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CSC3=NC=NC4=C3C=CS4

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CSC3=NC=NC4=C3C=CS4

InChI

InChI=1S/C23H20N4O4S2/c1-30-18-11-17(27-21(29)14-6-4-3-5-7-14)19(31-2)10-16(18)26-20(28)12-33-23-15-8-9-32-22(15)24-13-25-23/h3-11,13H,12H2,1-2H3,(H,26,28)(H,27,29)