S-[2-[[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] ethanethioate

Systemtic Name: S-[2-[[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]amino]-2-oxidanylidene-ethyl] ethanethioate Openeye Name: S-[2-[[4-(4-nitro-2-thienyl)thiazol-2-yl]amino]-2-oxo-ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[[4-(4-nitro-2-thiophenyl)-2-thiazolyl]amino]-2-oxoethyl] ester IUPAC Name: S-[2-[[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]amino]-2-oxoethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-keto-2-[[4-(4-nitro-2-thienyl)thiazol-2-yl]amino]ethyl] ester Formula: C11H9N3O4S3 MolecularWeight: 343.40186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)NC1=NC(=CS1)C2=CC(=CS2)[N+](=O)[O-]

Isomeric SMILES

CC(=O)SCC(=O)NC1=NC(=CS1)C2=CC(=CS2)[N+](=O)[O-]

InChI

InChI=1S/C11H9N3O4S3/c1-6(15)19-5-10(16)13-11-12-8(4-21-11)9-2-7(3-20-9)14(17)18/h2-4H,5H2,1H3,(H,12,13,16)