3-methyl-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-methyl-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-methyl-2-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one CAS Name: 3-methyl-2-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methylthio]-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-methyl-2-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-methyl-2-[(5-pyrrolidinosulfonyl-2-furyl)methylthio]thieno[2,3-d]pyrimidin-4-one Formula: C16H17N3O4S3 MolecularWeight: 411.51888

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(N=C1SCC3=CC=C(O3)S(=O)(=O)N4CCCC4)SC=C2

Isomeric SMILES

CN1C(=O)C2=C(N=C1SCC3=CC=C(O3)S(=O)(=O)N4CCCC4)SC=C2

InChI

InChI=1S/C16H17N3O4S3/c1-18-15(20)12-6-9-24-14(12)17-16(18)25-10-11-4-5-13(23-11)26(21,22)19-7-2-3-8-19/h4-6,9H,2-3,7-8,10H2,1H3