[(1S)-2-[3-[(4-ethanoylphenyl)sulfonylamino]propanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[3-[(4-ethanoylphenyl)sulfonylamino]propanoylamino]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[3-[(4-acetylphenyl)sulfonylamino]-1-oxopropyl]amino]-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-[3-[(4-acetylphenyl)sulfonylamino]propanoylamino]-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C19H26N3O4S2+ MolecularWeight: 424.55744

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O4S2/c1-14(23)15-4-6-17(7-5-15)28(25,26)21-10-8-19(24)20-12-18(22(2)3)16-9-11-27-13-16/h4-7,9,11,13,18,21H,8,10,12H2,1-3H3,(H,20,24)/p+1/t18-/m1/s1