3-[(2-chlorophenyl)methyl]-2-phenacylsulfanyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-[(2-chlorophenyl)methyl]-2-phenacylsulfanyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-[(2-chlorophenyl)methyl]-2-phenacylsulfanyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-[(2-chlorophenyl)methyl]-2-(phenacylthio)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-[(2-chlorophenyl)methyl]-2-phenacylsulfanylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-(2-chlorobenzyl)-2-(phenacylthio)thieno[3,2-d]pyrimidin-4-one Formula: C21H15ClN2O2S2 MolecularWeight: 426.939

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4Cl)SC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CSC2=NC3=C(C(=O)N2CC4=CC=CC=C4Cl)SC=C3

InChI

InChI=1S/C21H15ClN2O2S2/c22-16-9-5-4-8-15(16)12-24-20(26)19-17(10-11-27-19)23-21(24)28-13-18(25)14-6-2-1-3-7-14/h1-11H,12-13H2