[(1S)-2-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[3-[(2,5-dimethylphenyl)sulfonylamino]-1-oxopropyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[3-[(2,5-dimethylphenyl)sulfonylamino]propanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C19H28N3O3S2+ MolecularWeight: 410.57392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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