ethyl 5-azanyl-4-cyano-3-[3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanoyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanoyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[3-[5-(p-tolyl)oxazol-2-yl]propanoyloxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[3-[5-(4-methylphenyl)-2-oxazolyl]-1-oxopropoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanoyloxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[3-[5-(p-tolyl)oxazol-2-yl]propanoyloxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CCC2=NC=C(O2)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)CCC2=NC=C(O2)C3=CC=C(C=C3)C

InChI

InChI=1S/C22H21N3O5S/c1-3-28-22(27)20-16(15(10-23)21(24)31-20)12-29-19(26)9-8-18-25-11-17(30-18)14-6-4-13(2)5-7-14/h4-7,11H,3,8-9,12,24H2,1-2H3