N-[(4-chlorophenyl)methyl]-2-(6-ethyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-(6-ethyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-(6-ethyl-4-oxo-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[(6-ethyl-4-oxo-3-phenethyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-(6-ethyl-4-oxo-3-phenethylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(4-chlorobenzyl)-2-[(6-ethyl-4-keto-3-phenethyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C25H24ClN3O2S2 MolecularWeight: 498.05996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SCC(=O)NCC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(S1)N=C(N(C2=O)CCC3=CC=CC=C3)SCC(=O)NCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H24ClN3O2S2/c1-2-20-14-21-23(33-20)28-25(29(24(21)31)13-12-17-6-4-3-5-7-17)32-16-22(30)27-15-18-8-10-19(26)11-9-18/h3-11,14H,2,12-13,15-16H2,1H3,(H,27,30)