N1-butyl-N4-[(1R)-1-thiophen-2-ylethyl]benzene-1,4-disulfonamide

Systemtic Name: N1-butyl-N4-[(1R)-1-thiophen-2-ylethyl]benzene-1,4-disulfonamide Openeye Name: N1-butyl-N4-[(1R)-1-(2-thienyl)ethyl]benzene-1,4-disulfonamide CAS Name: N1-butyl-N4-[(1R)-1-thiophen-2-ylethyl]benzene-1,4-disulfonamide IUPAC Name: 1-N-butyl-4-N-[(1R)-1-thiophen-2-ylethyl]benzene-1,4-disulfonamide Traditional Name: N-butyl-N'-[(1R)-1-(2-thienyl)ethyl]benzene-1,4-disulfonamide Formula: C16H22N2O4S3 MolecularWeight: 402.55188

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC(C)C2=CC=CS2

Isomeric SMILES

CCCCNS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)N[C@H](C)C2=CC=CS2

InChI

InChI=1S/C16H22N2O4S3/c1-3-4-11-17-24(19,20)14-7-9-15(10-8-14)25(21,22)18-13(2)16-6-5-12-23-16/h5-10,12-13,17-18H,3-4,11H2,1-2H3/t13-/m1/s1