(NZ)-N-[2-cyclohexyl-3-cyclohexylimino-4-(phenylmethyl)-1,2,4-thiadiazolidin-5-ylidene]-3-nitro-benzenesulfonamide

Systemtic Name: (NZ)-N-[2-cyclohexyl-3-cyclohexylimino-4-(phenylmethyl)-1,2,4-thiadiazolidin-5-ylidene]-3-nitro-benzenesulfonamide Openeye Name: (NZ)-N-(4-benzyl-2-cyclohexyl-3-cyclohexylimino-1,2,4-thiadiazolidin-5-ylidene)-3-nitro-benzenesulfonamide CAS Name: (NZ)-N-[2-cyclohexyl-3-cyclohexylimino-4-(phenylmethyl)-1,2,4-thiadiazolidin-5-ylidene]-3-nitrobenzenesulfonamide IUPAC Name: (NZ)-N-(4-benzyl-2-cyclohexyl-3-cyclohexylimino-1,2,4-thiadiazolidin-5-ylidene)-3-nitrobenzenesulfonamide Traditional Name: (NZ)-N-(4-benzyl-2-cyclohexyl-3-cyclohexylimino-1,2,4-thiadiazolidin-5-ylidene)-3-nitro-benzenesulfonamide Formula: C27H33N5O4S2 MolecularWeight: 555.71202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N=C2N(C(=NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])SN2C4CCCCC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N=C2N(/C(=N/S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])/SN2C4CCCCC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H33N5O4S2/c33-32(34)24-17-10-18-25(19-24)38(35,36)29-27-30(20-21-11-4-1-5-12-21)26(28-22-13-6-2-7-14-22)31(37-27)23-15-8-3-9-16-23/h1,4-5,10-12,17-19,22-23H,2-3,6-9,13-16,20H2/b28-26?,29-27-