3-cyclohexyl-2-cyclohexylimino-5-[(3-iodanyl-5-nitro-2-oxidanyl-phenyl)methylidene]-1,3-thiazolidin-4-one

Systemtic Name: 3-cyclohexyl-2-cyclohexylimino-5-[(3-iodanyl-5-nitro-2-oxidanyl-phenyl)methylidene]-1,3-thiazolidin-4-one Openeye Name: 3-cyclohexyl-2-cyclohexylimino-5-[(2-hydroxy-3-iodo-5-nitro-phenyl)methylene]thiazolidin-4-one CAS Name: 3-cyclohexyl-2-cyclohexylimino-5-[(2-hydroxy-3-iodo-5-nitrophenyl)methylidene]-4-thiazolidinone IUPAC Name: 3-cyclohexyl-2-cyclohexylimino-5-[(2-hydroxy-3-iodo-5-nitrophenyl)methylidene]-1,3-thiazolidin-4-one Traditional Name: 3-cyclohexyl-2-cyclohexylimino-5-(2-hydroxy-3-iodo-5-nitro-benzylidene)thiazolidin-4-one Formula: C22H26IN3O4S MolecularWeight: 555.42901

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2N(C(=O)C(=CC3=CC(=CC(=C3O)I)[N+](=O)[O-])S2)C4CCCCC4

Isomeric SMILES

C1CCC(CC1)N=C2N(C(=O)C(=CC3=CC(=CC(=C3O)I)[N+](=O)[O-])S2)C4CCCCC4

InChI

InChI=1S/C22H26IN3O4S/c23-18-13-17(26(29)30)11-14(20(18)27)12-19-21(28)25(16-9-5-2-6-10-16)22(31-19)24-15-7-3-1-4-8-15/h11-13,15-16,27H,1-10H2