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

Systemtic Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-(1H-benzimidazol-2-ylsulfanylmethyl)-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1H-benzimidazol-2-ylthio)methyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H14N4OS2 MolecularWeight: 390.48136

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H14N4OS2/c25-18-17-13(12-6-2-1-3-7-12)10-26-19(17)24-16(23-18)11-27-20-21-14-8-4-5-9-15(14)22-20/h1-10H,11H2,(H,21,22)(H,23,24,25)