ethyl 5-azanyl-4-cyano-3-(2-quinolin-8-ylethanoyloxymethyl)thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-(2-quinolin-8-ylethanoyloxymethyl)thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[2-(8-quinolyl)acetyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[1-oxo-2-(8-quinolinyl)ethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(2-quinolin-8-ylacetyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[2-(8-quinolyl)acetyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C20H17N3O4S/c1-2-26-20(25)18-15(14(10-21)19(22)28-18)11-27-16(24)9-13-6-3-5-12-7-4-8-23-17(12)13/h3-8H,2,9,11,22H2,1H3