ethyl 2-[2-(4-cyanophenoxy)ethanoyl-pentyl-amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[2-(4-cyanophenoxy)ethanoyl-pentyl-amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[[2-(4-cyanophenoxy)acetyl]-pentyl-amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[2-(4-cyanophenoxy)-1-oxoethyl]-pentylamino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(4-cyanophenoxy)acetyl]-pentylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-[2-(4-cyanophenoxy)acetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)COC2=CC=C(C=C2)C#N

Isomeric SMILES

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)COC2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H25N3O4S/c1-4-6-7-12-24(21-23-15(3)19(29-21)20(26)27-5-2)18(25)14-28-17-10-8-16(13-22)9-11-17/h8-11H,4-7,12,14H2,1-3H3