(E)-2-(butanethioylamino)but-2-enoic acid

Systemtic Name: (E)-2-(butanethioylamino)but-2-enoic acid Openeye Name: (E)-2-(butanethioylamino)but-2-enoic acid CAS Name: (E)-2-(1-sulfanylidenebutylamino)-2-butenoic acid IUPAC Name: (E)-2-(butanethioylamino)but-2-enoic acid Traditional Name: (E)-2-(butanethioylamino)but-2-enoic acid Formula: C8H13NO2S MolecularWeight: 187.25932

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=S)NC(=CC)C(=O)O

Isomeric SMILES

CCCC(=S)N/C(=C/C)/C(=O)O

InChI

InChI=1S/C8H13NO2S/c1-3-5-7(12)9-6(4-2)8(10)11/h4H,3,5H2,1-2H3,(H,9,12)(H,10,11)/b6-4+