3-[4-methyl-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]thiolane 1,1-dioxide

Systemtic Name: 3-[4-methyl-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]thiolane 1,1-dioxide Openeye Name: 3-[4-methyl-5-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methylsulfanyl]-1,2,4-triazol-3-yl]thiolane 1,1-dioxide CAS Name: 3-[4-methyl-5-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methylthio]-1,2,4-triazol-3-yl]thiolane 1,1-dioxide IUPAC Name: 3-[4-methyl-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazol-3-yl]thiolane 1,1-dioxide Traditional Name: 3-[4-methyl-5-[(5-pyrrolidinosulfonyl-2-furyl)methylthio]-1,2,4-triazol-3-yl]sulfolane Formula: C16H22N4O5S3 MolecularWeight: 446.56468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(O2)S(=O)(=O)N3CCCC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(O2)S(=O)(=O)N3CCCC3)C4CCS(=O)(=O)C4

InChI

InChI=1S/C16H22N4O5S3/c1-19-15(12-6-9-27(21,22)11-12)17-18-16(19)26-10-13-4-5-14(25-13)28(23,24)20-7-2-3-8-20/h4-5,12H,2-3,6-11H2,1H3