4-[[2-(dimethylamino)-2-thiophen-2-yl-ethyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[2-(dimethylamino)-2-thiophen-2-yl-ethyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide Openeye Name: 4-[[2-(dimethylamino)-2-(2-thienyl)ethyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide CAS Name: 4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-N,N-diethyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[[2-(dimethylamino)-2-thiophen-2-ylethyl]amino]-N,N-diethyl-3-nitrobenzenesulfonamide Traditional Name: 4-[[2-(dimethylamino)-2-(2-thienyl)ethyl]amino]-N,N-diethyl-3-nitro-benzenesulfonamide Formula: C18H26N4O4S2 MolecularWeight: 426.55344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC(C2=CC=CS2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)NCC(C2=CC=CS2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O4S2/c1-5-21(6-2)28(25,26)14-9-10-15(16(12-14)22(23)24)19-13-17(20(3)4)18-8-7-11-27-18/h7-12,17,19H,5-6,13H2,1-4H3