dimethyl-[(1R)-2-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1R)-2-[(4-piperidin-1-ylsulfonylphenyl)carbonylamino]-1-thiophen-2-yl-ethyl]azanium Openeye Name: dimethyl-[(1R)-2-[[4-(1-piperidylsulfonyl)benzoyl]amino]-1-(2-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1R)-2-[[oxo-[4-(1-piperidinylsulfonyl)phenyl]methyl]amino]-1-thiophen-2-ylethyl]ammonium IUPAC Name: dimethyl-[(1R)-2-[(4-piperidin-1-ylsulfonylbenzoyl)amino]-1-thiophen-2-ylethyl]azanium Traditional Name: dimethyl-[(1R)-2-[(4-piperidinosulfonylbenzoyl)amino]-1-(2-thienyl)ethyl]ammonium Formula: C20H28N3O3S2+ MolecularWeight: 422.58462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)C3=CC=CS3

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)C3=CC=CS3

InChI

InChI=1S/C20H27N3O3S2/c1-22(2)18(19-7-6-14-27-19)15-21-20(24)16-8-10-17(11-9-16)28(25,26)23-12-4-3-5-13-23/h6-11,14,18H,3-5,12-13,15H2,1-2H3,(H,21,24)/p+1/t18-/m1/s1