2-[4-oxidanylidene-5-phenyl-3-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanylethanamide

Systemtic Name: 2-[4-oxidanylidene-5-phenyl-3-(phenylmethyl)thieno[2,3-d]pyrimidin-2-yl]sulfanylethanamide Openeye Name: 2-(3-benzyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide CAS Name: 2-[[4-oxo-5-phenyl-3-(phenylmethyl)-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-benzyl-4-keto-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C21H17N3O2S2 MolecularWeight: 407.50858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(N=C2SCC(=O)N)SC=C3C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(N=C2SCC(=O)N)SC=C3C4=CC=CC=C4

InChI

InChI=1S/C21H17N3O2S2/c22-17(25)13-28-21-23-19-18(16(12-27-19)15-9-5-2-6-10-15)20(26)24(21)11-14-7-3-1-4-8-14/h1-10,12H,11,13H2,(H2,22,25)