3-[3-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1,3-thiazolidin-2-one

Systemtic Name: 3-[3-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-3-oxidanylidene-propyl]-1,3-thiazolidin-2-one Openeye Name: 3-[3-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]-3-oxo-propyl]thiazolidin-2-one CAS Name: 3-[3-[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-3-oxopropyl]-2-thiazolidinone IUPAC Name: 3-[3-[4-(4-methylsulfonyl-2-nitrophenyl)piperazin-1-yl]-3-oxopropyl]-1,3-thiazolidin-2-one Traditional Name: 3-[3-keto-3-[4-(4-mesyl-2-nitro-phenyl)piperazino]propyl]thiazolidin-2-one Formula: C17H22N4O6S2 MolecularWeight: 442.50978

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CCN3CCSC3=O)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CCN3CCSC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O6S2/c1-29(26,27)13-2-3-14(15(12-13)21(24)25)18-6-8-19(9-7-18)16(22)4-5-20-10-11-28-17(20)23/h2-3,12H,4-11H2,1H3