N4-[(2S)-butan-2-yl]-N4-[(4-tert-butylphenyl)methyl]-N1-cyclopentyl-benzene-1,4-disulfonamide

Systemtic Name: N4-[(2S)-butan-2-yl]-N4-[(4-tert-butylphenyl)methyl]-N1-cyclopentyl-benzene-1,4-disulfonamide Openeye Name: N4-[(4-tert-butylphenyl)methyl]-N1-cyclopentyl-N4-[(1S)-1-methylpropyl]benzene-1,4-disulfonamide CAS Name: N4-[(2S)-butan-2-yl]-N4-[(4-tert-butylphenyl)methyl]-N1-cyclopentylbenzene-1,4-disulfonamide IUPAC Name: 4-N-[(2S)-butan-2-yl]-4-N-[(4-tert-butylphenyl)methyl]-1-N-cyclopentylbenzene-1,4-disulfonamide Traditional Name: N'-(4-tert-butylbenzyl)-N-cyclopentyl-N'-[(1S)-1-methylpropyl]benzene-1,4-disulfonamide Formula: C26H38N2O4S2 MolecularWeight: 506.72092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=C(C=C1)C(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CCCC3

Isomeric SMILES

CC[C@H](C)N(CC1=CC=C(C=C1)C(C)(C)C)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)NC3CCCC3

InChI

InChI=1S/C26H38N2O4S2/c1-6-20(2)28(19-21-11-13-22(14-12-21)26(3,4)5)34(31,32)25-17-15-24(16-18-25)33(29,30)27-23-9-7-8-10-23/h11-18,20,23,27H,6-10,19H2,1-5H3/t20-/m0/s1