ethyl 5-azanyl-4-cyano-3-[(1-phenylcyclopropyl)carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[(1-phenylcyclopropyl)carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[(1-phenylcyclopropanecarbonyl)oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[oxo-(1-phenylcyclopropyl)methoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[(1-phenylcyclopropanecarbonyl)oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[(1-phenylcyclopropanecarbonyl)oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C19H18N2O4S MolecularWeight: 370.42222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2(CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O4S/c1-2-24-17(22)15-14(13(10-20)16(21)26-15)11-25-18(23)19(8-9-19)12-6-4-3-5-7-12/h3-7H,2,8-9,11,21H2,1H3