5-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1-[[(2R)-oxolan-2-yl]methyl]-1,2,3,4-tetrazole

Systemtic Name: 5-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1-[[(2R)-oxolan-2-yl]methyl]-1,2,3,4-tetrazole Openeye Name: 5-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]tetrazole CAS Name: 5-[(4-methylsulfonyl-2-nitrophenyl)thio]-1-[[(2R)-2-oxolanyl]methyl]tetrazole IUPAC Name: 5-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-1-[[(2R)-oxolan-2-yl]methyl]tetrazole Traditional Name: 5-[(4-mesyl-2-nitro-phenyl)thio]-1-[[(2R)-tetrahydrofuran-2-yl]methyl]tetrazole Formula: C13H15N5O5S2 MolecularWeight: 385.4187

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NN=NN2CC3CCCO3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NN=NN2C[C@H]3CCCO3)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O5S2/c1-25(21,22)10-4-5-12(11(7-10)18(19)20)24-13-14-15-16-17(13)8-9-3-2-6-23-9/h4-5,7,9H,2-3,6,8H2,1H3/t9-/m1/s1