4-methyl-3-phenyl-2-sulfanylidene-1,3-thiazole-5-carboxylate

Systemtic Name: 4-methyl-3-phenyl-2-sulfanylidene-1,3-thiazole-5-carboxylate Openeye Name: 4-methyl-3-phenyl-2-thioxo-thiazole-5-carboxylate CAS Name: 4-methyl-3-phenyl-2-sulfanylidene-5-thiazolecarboxylate IUPAC Name: 4-methyl-3-phenyl-2-sulfanylidene-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-3-phenyl-2-thioxo-4-thiazoline-5-carboxylate Formula: C11H8NO2S2- MolecularWeight: 250.31672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=S)N1C2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=C(SC(=S)N1C2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C11H9NO2S2/c1-7-9(10(13)14)16-11(15)12(7)8-5-3-2-4-6-8/h2-6H,1H3,(H,13,14)/p-1