4-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-5-nitro-phenyl]sulfonylmorpholine

Systemtic Name: 4-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]-5-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[2-(1-cyclopropyltetrazol-5-yl)sulfanyl-5-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[2-[(1-cyclopropyl-5-tetrazolyl)thio]-5-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[2-(1-cyclopropyltetrazol-5-yl)sulfanyl-5-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[2-[(1-cyclopropyltetrazol-5-yl)thio]-5-nitro-phenyl]sulfonylmorpholine Formula: C14H16N6O5S2 MolecularWeight: 412.44404

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CC1N2C(=NN=N2)SC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C14H16N6O5S2/c21-20(22)11-3-4-12(26-14-15-16-17-19(14)10-1-2-10)13(9-11)27(23,24)18-5-7-25-8-6-18/h3-4,9-10H,1-2,5-8H2