ethyl 5-azanyl-2-phenyl-3-sulfanylidene-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-2-phenyl-3-sulfanylidene-1,2-thiazole-4-carboxylate Openeye Name: ethyl 5-amino-2-phenyl-3-thioxo-isothiazole-4-carboxylate CAS Name: 5-amino-2-phenyl-3-sulfanylidene-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-2-phenyl-3-sulfanylidene-1,2-thiazole-4-carboxylate Traditional Name: 5-amino-2-phenyl-3-thioxo-4-isothiazoline-4-carboxylic acid ethyl ester Formula: C12H12N2O2S2 MolecularWeight: 280.36588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SN(C1=S)C2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)C1=C(SN(C1=S)C2=CC=CC=C2)N

InChI

InChI=1S/C12H12N2O2S2/c1-2-16-12(15)9-10(13)18-14(11(9)17)8-6-4-3-5-7-8/h3-7H,2,13H2,1H3