ethyl 5-azanyl-4-cyano-3-[(2-fluorophenyl)sulfanylmethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(2-fluorophenyl)sulfanylmethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(2-fluorophenyl)sulfanylmethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(2-fluorophenyl)thio]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(2-fluorophenyl)sulfanylmethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[(2-fluorophenyl)thio]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C15H13FN2O2S2 MolecularWeight: 336.404323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=CC=CC=C2F

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)CSC2=CC=CC=C2F

InChI

InChI=1S/C15H13FN2O2S2/c1-2-20-15(19)13-10(9(7-17)14(18)22-13)8-21-12-6-4-3-5-11(12)16/h3-6H,2,8,18H2,1H3