[(1R)-2-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-1-thiophen-2-yl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[3-[(3,4-dimethylphenyl)sulfonylamino]-1-oxopropyl]amino]-1-thiophen-2-ylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-1-thiophen-2-ylethyl]-dimethylazanium Traditional Name: [(1R)-2-[3-[(3,4-dimethylphenyl)sulfonylamino]propanoylamino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C19H28N3O3S2+ MolecularWeight: 410.57392

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NCC(C2=CC=CS2)[NH+](C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCCC(=O)NC[C@H](C2=CC=CS2)[NH+](C)C)C

InChI

InChI=1S/C19H27N3O3S2/c1-14-7-8-16(12-15(14)2)27(24,25)21-10-9-19(23)20-13-17(22(3)4)18-6-5-11-26-18/h5-8,11-12,17,21H,9-10,13H2,1-4H3,(H,20,23)/p+1/t17-/m1/s1