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

Systemtic Name: N1-cyclohexyl-N1-ethyl-N4-[(4-methylphenyl)methyl]-N4-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide Openeye Name: N1-cyclohexyl-N1-ethyl-N4-(p-tolylmethyl)-N4-(2-thienylmethyl)benzene-1,4-disulfonamide CAS Name: N1-cyclohexyl-N1-ethyl-N4-[(4-methylphenyl)methyl]-N4-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide IUPAC Name: 1-N-cyclohexyl-1-N-ethyl-4-N-[(4-methylphenyl)methyl]-4-N-(thiophen-2-ylmethyl)benzene-1,4-disulfonamide Traditional Name: N-cyclohexyl-N-ethyl-N'-(4-methylbenzyl)-N'-(2-thenyl)benzene-1,4-disulfonamide Formula: C27H34N2O4S3 MolecularWeight: 546.76486

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=C(C=C3)C)CC4=CC=CS4

Isomeric SMILES

CCN(C1CCCCC1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CC3=CC=C(C=C3)C)CC4=CC=CS4

InChI

InChI=1S/C27H34N2O4S3/c1-3-29(24-8-5-4-6-9-24)36(32,33)27-17-15-26(16-18-27)35(30,31)28(21-25-10-7-19-34-25)20-23-13-11-22(2)12-14-23/h7,10-19,24H,3-6,8-9,20-21H2,1-2H3