S-ethyl (E)-3-azanyl-2-(propanoylamino)but-2-enethioate

Systemtic Name: S-ethyl (E)-3-azanyl-2-(propanoylamino)but-2-enethioate Openeye Name: S-ethyl (E)-3-amino-2-(propanoylamino)but-2-enethioate CAS Name: (E)-3-amino-2-(1-oxopropylamino)-2-butenethioic acid S-ethyl ester IUPAC Name: S-ethyl (E)-3-amino-2-(propanoylamino)but-2-enethioate Traditional Name: (E)-3-amino-2-propionamido-but-2-enethioic acid S-ethyl ester Formula: C9H16N2O2S MolecularWeight: 216.30054

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(=C(C)N)C(=O)SCC

Isomeric SMILES

CCC(=O)N/C(=C(\C)/N)/C(=O)SCC

InChI

InChI=1S/C9H16N2O2S/c1-4-7(12)11-8(6(3)10)9(13)14-5-2/h4-5,10H2,1-3H3,(H,11,12)/b8-6+