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

Systemtic Name: 3-cyclohexyl-2-cyclohexylimino-5-[(5-methoxy-2-nitro-4-phenylmethoxy-phenyl)methylidene]-1,3-thiazolidin-4-one Openeye Name: 5-[(4-benzyloxy-5-methoxy-2-nitro-phenyl)methylene]-3-cyclohexyl-2-cyclohexylimino-thiazolidin-4-one CAS Name: 3-cyclohexyl-2-cyclohexylimino-5-[(5-methoxy-2-nitro-4-phenylmethoxyphenyl)methylidene]-4-thiazolidinone IUPAC Name: 3-cyclohexyl-2-cyclohexylimino-5-[(5-methoxy-2-nitro-4-phenylmethoxyphenyl)methylidene]-1,3-thiazolidin-4-one Traditional Name: 5-(4-benzoxy-5-methoxy-2-nitro-benzylidene)-3-cyclohexyl-2-cyclohexylimino-thiazolidin-4-one Formula: C30H35N3O5S MolecularWeight: 549.681

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C=C2C(=O)N(C(=NC3CCCCC3)S2)C4CCCCC4)[N+](=O)[O-])OCC5=CC=CC=C5

Isomeric SMILES

COC1=C(C=C(C(=C1)C=C2C(=O)N(C(=NC3CCCCC3)S2)C4CCCCC4)[N+](=O)[O-])OCC5=CC=CC=C5

InChI

InChI=1S/C30H35N3O5S/c1-37-26-17-22(25(33(35)36)19-27(26)38-20-21-11-5-2-6-12-21)18-28-29(34)32(24-15-9-4-10-16-24)30(39-28)31-23-13-7-3-8-14-23/h2,5-6,11-12,17-19,23-24H,3-4,7-10,13-16,20H2,1H3