ethyl 5-azanyl-4-cyano-3-[(7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl)oxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl)oxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(7-fluoro-1-methyl-3-oxo-indan-4-yl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[(7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl)oxymethyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(7-fluoro-3-keto-1-methyl-indan-4-yl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H17FN2O4S MolecularWeight: 388.412683

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=C3C(=O)CC(C3=C(C=C2)F)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC2=C3C(=O)CC(C3=C(C=C2)F)C

InChI

InChI=1S/C19H17FN2O4S/c1-3-25-19(24)17-11(10(7-21)18(22)27-17)8-26-14-5-4-12(20)15-9(2)6-13(23)16(14)15/h4-5,9H,3,6,8,22H2,1-2H3