ethyl 5-azanyl-4-cyano-3-[[(2S)-2-phenoxypropanoyl]oxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[(2S)-2-phenoxypropanoyl]oxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[(2S)-2-phenoxypropanoyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(2S)-1-oxo-2-phenoxypropoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[(2S)-2-phenoxypropanoyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[(2S)-2-phenoxypropanoyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C(C)OC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)[C@H](C)OC2=CC=CC=C2

InChI

InChI=1S/C18H18N2O5S/c1-3-23-18(22)15-14(13(9-19)16(20)26-15)10-24-17(21)11(2)25-12-7-5-4-6-8-12/h4-8,11H,3,10,20H2,1-2H3/t11-/m0/s1