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

Systemtic Name: 2-[5-(2-chlorophenyl)-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylethanamide Openeye Name: 2-[5-(2-chlorophenyl)-4-oxo-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide CAS Name: 2-[[5-(2-chlorophenyl)-4-oxo-3-phenethyl-2-thieno[2,3-d]pyrimidinyl]thio]acetamide IUPAC Name: 2-[5-(2-chlorophenyl)-4-oxo-3-phenethylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide Traditional Name: 2-[[5-(2-chlorophenyl)-4-keto-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl]thio]acetamide Formula: C22H18ClN3O2S2 MolecularWeight: 455.98022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(N=C2SCC(=O)N)SC=C3C4=CC=CC=C4Cl

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(N=C2SCC(=O)N)SC=C3C4=CC=CC=C4Cl

InChI

InChI=1S/C22H18ClN3O2S2/c23-17-9-5-4-8-15(17)16-12-29-20-19(16)21(28)26(22(25-20)30-13-18(24)27)11-10-14-6-2-1-3-7-14/h1-9,12H,10-11,13H2,(H2,24,27)