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

Systemtic Name: N-(phenylmethyl)-2-(2-thieno[3,2-d]pyrimidin-4-ylsulfanylethanoylamino)benzamide Openeye Name: N-benzyl-2-[(2-thieno[3,2-d]pyrimidin-4-ylsulfanylacetyl)amino]benzamide CAS Name: 2-[[1-oxo-2-(4-thieno[3,2-d]pyrimidinylthio)ethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-2-[(2-thieno[3,2-d]pyrimidin-4-ylsulfanylacetyl)amino]benzamide Traditional Name: N-benzyl-2-[[2-(thieno[3,2-d]pyrimidin-4-ylthio)acetyl]amino]benzamide Formula: C22H18N4O2S2 MolecularWeight: 434.53392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)CSC3=NC=NC4=C3SC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=CC=CC=C2NC(=O)CSC3=NC=NC4=C3SC=C4

InChI

InChI=1S/C22H18N4O2S2/c27-19(13-30-22-20-18(10-11-29-20)24-14-25-22)26-17-9-5-4-8-16(17)21(28)23-12-15-6-2-1-3-7-15/h1-11,14H,12-13H2,(H,23,28)(H,26,27)