N-(2-methoxyphenyl)-4-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)benzamide

Systemtic Name: N-(2-methoxyphenyl)-4-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)benzamide Openeye Name: N-(2-methoxyphenyl)-4-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]benzamide CAS Name: N-(2-methoxyphenyl)-4-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]amino]benzamide IUPAC Name: N-(2-methoxyphenyl)-4-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]benzamide Traditional Name: N-(2-methoxyphenyl)-4-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]amino]benzamide Formula: C22H18N4O3S2 MolecularWeight: 450.53332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H18N4O3S2/c1-29-18-5-3-2-4-17(18)26-20(28)14-6-8-15(9-7-14)25-19(27)12-31-22-16-10-11-30-21(16)23-13-24-22/h2-11,13H,12H2,1H3,(H,25,27)(H,26,28)