ethyl 5-azanyl-4-cyano-3-[(3-phenylthiophen-2-yl)carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(3-phenylthiophen-2-yl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(3-phenylthiophene-2-carbonyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[oxo-(3-phenyl-2-thiophenyl)methoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(3-phenylthiophene-2-carbonyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(3-phenylthiophene-2-carbonyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H16N2O4S2 MolecularWeight: 412.48204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C=CS2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=C(C=CS2)C3=CC=CC=C3

InChI

InChI=1S/C20H16N2O4S2/c1-2-25-20(24)17-15(14(10-21)18(22)28-17)11-26-19(23)16-13(8-9-27-16)12-6-4-3-5-7-12/h3-9H,2,11,22H2,1H3