N1-cyclohexyl-N4-[2-(3,4-dimethoxyphenyl)ethyl]-N1-methyl-N4-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide

Systemtic Name: N1-cyclohexyl-N4-[2-(3,4-dimethoxyphenyl)ethyl]-N1-methyl-N4-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide Openeye Name: N1-cyclohexyl-N4-[2-(3,4-dimethoxyphenyl)ethyl]-N1-methyl-N4-(2-thienylmethyl)benzene-1,4-disulfonamide CAS Name: N1-cyclohexyl-N4-[2-(3,4-dimethoxyphenyl)ethyl]-N1-methyl-N4-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide IUPAC Name: 1-N-cyclohexyl-4-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-N-methyl-4-N-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide Traditional Name: N-cyclohexyl-N'-homoveratryl-N-methyl-N'-(2-thenyl)benzene-1,4-disulfonamide Formula: C28H36N2O6S3 MolecularWeight: 592.79024

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC3=CC(=C(C=C3)OC)OC)CC4=CC=CS4

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC3=CC(=C(C=C3)OC)OC)CC4=CC=CS4

InChI

InChI=1S/C28H36N2O6S3/c1-29(23-8-5-4-6-9-23)38(31,32)25-12-14-26(15-13-25)39(33,34)30(21-24-10-7-19-37-24)18-17-22-11-16-27(35-2)28(20-22)36-3/h7,10-16,19-20,23H,4-6,8-9,17-18,21H2,1-3H3