2-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]methylsulfanyl]-3-methyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]methylsulfanyl]-3-methyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(1-benzyl-5-chloro-benzimidazol-2-yl)methylsulfanyl]-3-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]methylthio]-3-methyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-[(1-benzyl-5-chlorobenzimidazol-2-yl)methylsulfanyl]-3-methylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(1-benzyl-5-chloro-benzimidazol-2-yl)methylthio]-3-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C22H17ClN4OS2 MolecularWeight: 452.97958

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=NC4=C(N3CC5=CC=CC=C5)C=CC(=C4)Cl)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=NC4=C(N3CC5=CC=CC=C5)C=CC(=C4)Cl)SC=C2

InChI

InChI=1S/C22H17ClN4OS2/c1-26-21(28)16-9-10-29-20(16)25-22(26)30-13-19-24-17-11-15(23)7-8-18(17)27(19)12-14-5-3-2-4-6-14/h2-11H,12-13H2,1H3