ethyl 5-azanyl-4-cyano-3-[[(E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoyl]oxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[(E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoyl]oxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[(E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[(E)-3-[4-(cyanomethoxy)phenyl]-1-oxoprop-2-enoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[(E)-3-[4-(cyanomethoxy)phenyl]prop-2-enoyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[(E)-3-[4-(cyanomethoxy)phenyl]acryloyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O5S/c1-2-26-20(25)18-16(15(11-22)19(23)29-18)12-28-17(24)8-5-13-3-6-14(7-4-13)27-10-9-21/h3-8H,2,10,12,23H2,1H3/b8-5+