(3S)-3-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]thiolane 1,1-dioxide

Systemtic Name: (3S)-3-[4-(4-morpholin-4-ylsulfonyl-2-nitro-phenyl)piperazin-1-yl]thiolane 1,1-dioxide Openeye Name: (3S)-3-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazin-1-yl]thiolane 1,1-dioxide CAS Name: (3S)-3-[4-[4-(4-morpholinylsulfonyl)-2-nitrophenyl]-1-piperazinyl]thiolane 1,1-dioxide IUPAC Name: (3S)-3-[4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazin-1-yl]thiolane 1,1-dioxide Traditional Name: (3S)-3-[4-(4-morpholinosulfonyl-2-nitro-phenyl)piperazino]sulfolane Formula: C18H26N4O7S2 MolecularWeight: 474.55164

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O7S2/c23-22(24)18-13-16(31(27,28)21-8-10-29-11-9-21)1-2-17(18)20-6-4-19(5-7-20)15-3-12-30(25,26)14-15/h1-2,13,15H,3-12,14H2/t15-/m0/s1