[(1S)-2-[[3-(cyclopentylsulfamoyl)-4-methoxy-phenyl]carbonylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[[3-(cyclopentylsulfamoyl)-4-methoxy-phenyl]carbonylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[[3-(cyclopentylsulfamoyl)-4-methoxy-benzoyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[[3-(cyclopentylsulfamoyl)-4-methoxyphenyl]-oxomethyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[[3-(cyclopentylsulfamoyl)-4-methoxybenzoyl]amino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[[3-(cyclopentylsulfamoyl)-4-methoxy-benzoyl]amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C21H30N3O4S2+ MolecularWeight: 452.6106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC(=C(C=C1)OC)S(=O)(=O)NC2CCCC2)C3=CC=CS3

Isomeric SMILES

C[NH+](C)[C@@H](CNC(=O)C1=CC(=C(C=C1)OC)S(=O)(=O)NC2CCCC2)C3=CC=CS3

InChI

InChI=1S/C21H29N3O4S2/c1-24(2)17(19-9-6-12-29-19)14-22-21(25)15-10-11-18(28-3)20(13-15)30(26,27)23-16-7-4-5-8-16/h6,9-13,16-17,23H,4-5,7-8,14H2,1-3H3,(H,22,25)/p+1/t17-/m0/s1