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

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-(4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[(4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-(4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(4-chlorobenzyl)-2-[(4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C21H16ClN3O2S2 MolecularWeight: 441.95364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NCC4=CC=C(C=C4)Cl)SC=C3

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCC(=O)NCC4=CC=C(C=C4)Cl)SC=C3

InChI

InChI=1S/C21H16ClN3O2S2/c22-15-8-6-14(7-9-15)12-23-18(26)13-29-21-24-19-17(10-11-28-19)20(27)25(21)16-4-2-1-3-5-16/h1-11H,12-13H2,(H,23,26)