3-[[2-[2-(dimethylazaniumyl)ethanoylamino]-4,5-dimethyl-thiophen-3-yl]carbonylamino]propanoate

Systemtic Name: 3-[[2-[2-(dimethylazaniumyl)ethanoylamino]-4,5-dimethyl-thiophen-3-yl]carbonylamino]propanoate Openeye Name: 3-[[2-[[2-(dimethylammonio)acetyl]amino]-4,5-dimethyl-thiophene-3-carbonyl]amino]propanoate CAS Name: 3-[[[2-[[2-(dimethylammonio)-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenyl]-oxomethyl]amino]propanoate IUPAC Name: 3-[[2-[[2-(dimethylazaniumyl)acetyl]amino]-4,5-dimethylthiophene-3-carbonyl]amino]propanoate Traditional Name: 3-[[2-[[2-(dimethylammonio)acetyl]amino]-4,5-dimethyl-thiophene-3-carbonyl]amino]propionate Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)NCCC(=O)[O-])NC(=O)C[NH+](C)C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)NCCC(=O)[O-])NC(=O)C[NH+](C)C)C

InChI

InChI=1S/C14H21N3O4S/c1-8-9(2)22-14(16-10(18)7-17(3)4)12(8)13(21)15-6-5-11(19)20/h5-7H2,1-4H3,(H,15,21)(H,16,18)(H,19,20)