3-(furan-2-yl)-4-methyl-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazole

Systemtic Name: 3-(furan-2-yl)-4-methyl-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazole Openeye Name: 3-(2-furyl)-4-methyl-5-[(5-pyrrolidin-1-ylsulfonyl-2-furyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-furanyl)-4-methyl-5-[[5-(1-pyrrolidinylsulfonyl)-2-furanyl]methylthio]-1,2,4-triazole IUPAC Name: 3-(furan-2-yl)-4-methyl-5-[(5-pyrrolidin-1-ylsulfonylfuran-2-yl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-(2-furyl)-4-methyl-5-[(5-pyrrolidinosulfonyl-2-furyl)methylthio]-1,2,4-triazole Formula: C16H18N4O4S2 MolecularWeight: 394.46852

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCC2=CC=C(O2)S(=O)(=O)N3CCCC3)C4=CC=CO4

Isomeric SMILES

CN1C(=NN=C1SCC2=CC=C(O2)S(=O)(=O)N3CCCC3)C4=CC=CO4

InChI

InChI=1S/C16H18N4O4S2/c1-19-15(13-5-4-10-23-13)17-18-16(19)25-11-12-6-7-14(24-12)26(21,22)20-8-2-3-9-20/h4-7,10H,2-3,8-9,11H2,1H3