2-(1H-benzimidazol-2-ylsulfanylmethyl)-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-5-(2-chlorophenyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H13ClN4OS2 MolecularWeight: 424.92642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CSC3=C2C(=O)NC(=N3)CSC4=NC5=CC=CC=C5N4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C2=CSC3=C2C(=O)NC(=N3)CSC4=NC5=CC=CC=C5N4)Cl

InChI

InChI=1S/C20H13ClN4OS2/c21-13-6-2-1-5-11(13)12-9-27-19-17(12)18(26)24-16(25-19)10-28-20-22-14-7-3-4-8-15(14)23-20/h1-9H,10H2,(H,22,23)(H,24,25,26)