3-(furan-2-ylmethyl)-6-methyl-2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(furan-2-ylmethyl)-6-methyl-2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(2-furylmethyl)-6-methyl-2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(2-furanylmethyl)-6-methyl-2-[(6-methyl-1H-benzimidazol-2-yl)methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(furan-2-ylmethyl)-6-methyl-2-[(6-methyl-1H-benzimidazol-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(2-furfuryl)-6-methyl-2-[(6-methyl-1H-benzimidazol-2-yl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)CSC3=NC4=C(C=C(S4)C)C(=O)N3CC5=CC=CO5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)CSC3=NC4=C(C=C(S4)C)C(=O)N3CC5=CC=CO5

InChI

InChI=1S/C21H18N4O2S2/c1-12-5-6-16-17(8-12)23-18(22-16)11-28-21-24-19-15(9-13(2)29-19)20(26)25(21)10-14-4-3-7-27-14/h3-9H,10-11H2,1-2H3,(H,22,23)