methyl 2-(1,3-dithiol-2-ylidene)-3-oxidanylidene-3-phenylazanyl-propanoate

Systemtic Name: methyl 2-(1,3-dithiol-2-ylidene)-3-oxidanylidene-3-phenylazanyl-propanoate Openeye Name: methyl 3-anilino-2-(1,3-dithiol-2-ylidene)-3-oxo-propanoate CAS Name: 3-anilino-2-(1,3-dithiol-2-ylidene)-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-anilino-2-(1,3-dithiol-2-ylidene)-3-oxopropanoate Traditional Name: 3-anilino-2-(1,3-dithiol-2-ylidene)-3-keto-propionic acid methyl ester Formula: C13H11NO3S2 MolecularWeight: 293.36134

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(=C1SC=CS1)C(=O)NC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(=C1SC=CS1)C(=O)NC2=CC=CC=C2

InChI

InChI=1S/C13H11NO3S2/c1-17-12(16)10(13-18-7-8-19-13)11(15)14-9-5-3-2-4-6-9/h2-8H,1H3,(H,14,15)