ethyl 2-(1,3-dithiol-2-ylidene)-3-oxidanylidene-3-[(2-oxidanylidenethiolan-3-yl)amino]propanoate

Systemtic Name: ethyl 2-(1,3-dithiol-2-ylidene)-3-oxidanylidene-3-[(2-oxidanylidenethiolan-3-yl)amino]propanoate Openeye Name: ethyl 2-(1,3-dithiol-2-ylidene)-3-oxo-3-[(2-oxotetrahydrothiophen-3-yl)amino]propanoate CAS Name: 2-(1,3-dithiol-2-ylidene)-3-oxo-3-[(2-oxo-3-thiolanyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 2-(1,3-dithiol-2-ylidene)-3-oxo-3-[(2-oxothiolan-3-yl)amino]propanoate Traditional Name: 2-(1,3-dithiol-2-ylidene)-3-keto-3-[(2-ketotetrahydrothiophen-3-yl)amino]propionic acid ethyl ester Formula: C12H13NO4S3 MolecularWeight: 331.43092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C1SC=CS1)C(=O)NC2CCSC2=O

Isomeric SMILES

CCOC(=O)C(=C1SC=CS1)C(=O)NC2CCSC2=O

InChI

InChI=1S/C12H13NO4S3/c1-2-17-10(15)8(12-19-5-6-20-12)9(14)13-7-3-4-18-11(7)16/h5-7H,2-4H2,1H3,(H,13,14)