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

Systemtic Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-phenyl]sulfonylmorpholine Openeye Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitro-phenyl]sulfonylmorpholine CAS Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-5-nitrophenyl]sulfonylmorpholine IUPAC Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)sulfanyl]-5-nitrophenyl]sulfonylmorpholine Traditional Name: 4-[2-[(5-cyclopropyl-1H-1,2,4-triazol-3-yl)thio]-5-nitro-phenyl]sulfonylmorpholine Formula: C15H17N5O5S2 MolecularWeight: 411.45598

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2)SC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1CC1C2=NC(=NN2)SC3=C(C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C15H17N5O5S2/c21-20(22)11-3-4-12(26-15-16-14(17-18-15)10-1-2-10)13(9-11)27(23,24)19-5-7-25-8-6-19/h3-4,9-10H,1-2,5-8H2,(H,16,17,18)