3-cyclohexyl-2-cyclohexylimino-5-[[3-ethoxy-5-iodanyl-4-[(3-nitrophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidin-4-one

Systemtic Name: 3-cyclohexyl-2-cyclohexylimino-5-[[3-ethoxy-5-iodanyl-4-[(3-nitrophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidin-4-one Openeye Name: 3-cyclohexyl-2-cyclohexylimino-5-[[3-ethoxy-5-iodo-4-[(3-nitrophenyl)methoxy]phenyl]methylene]thiazolidin-4-one CAS Name: 3-cyclohexyl-2-cyclohexylimino-5-[[3-ethoxy-5-iodo-4-[(3-nitrophenyl)methoxy]phenyl]methylidene]-4-thiazolidinone IUPAC Name: 3-cyclohexyl-2-cyclohexylimino-5-[[3-ethoxy-5-iodo-4-[(3-nitrophenyl)methoxy]phenyl]methylidene]-1,3-thiazolidin-4-one Traditional Name: 3-cyclohexyl-2-cyclohexylimino-5-[3-ethoxy-5-iodo-4-(3-nitrobenzyl)oxy-benzylidene]thiazolidin-4-one Formula: C31H36IN3O5S MolecularWeight: 689.60411

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=NC3CCCCC3)S2)C4CCCCC4)I)OCC5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=NC3CCCCC3)S2)C4CCCCC4)I)OCC5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C31H36IN3O5S/c1-2-39-27-18-22(17-26(32)29(27)40-20-21-10-9-15-25(16-21)35(37)38)19-28-30(36)34(24-13-7-4-8-14-24)31(41-28)33-23-11-5-3-6-12-23/h9-10,15-19,23-24H,2-8,11-14,20H2,1H3