ethyl 2-oxidanyl-4-phenyl-5-thiocyanato-thiophene-3-carboxylate

Systemtic Name: ethyl 2-oxidanyl-4-phenyl-5-thiocyanato-thiophene-3-carboxylate Openeye Name: ethyl 2-hydroxy-4-phenyl-5-thiocyanato-thiophene-3-carboxylate CAS Name: 2-hydroxy-4-phenyl-5-thiocyanato-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-4-phenyl-5-thiocyanatothiophene-3-carboxylate Traditional Name: 2-hydroxy-4-phenyl-5-thiocyanato-thiophene-3-carboxylic acid ethyl ester Formula: C14H11NO3S2 MolecularWeight: 305.37204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)SC#N)O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)SC#N)O

InChI

InChI=1S/C14H11NO3S2/c1-2-18-12(16)11-10(9-6-4-3-5-7-9)14(19-8-15)20-13(11)17/h3-7,17H,2H2,1H3