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

Systemtic Name: ethyl 4-methyl-2-[2-(4-nitrophenoxy)ethanoyl-pentyl-amino]-1,3-thiazole-5-carboxylate Openeye Name: ethyl 4-methyl-2-[[2-(4-nitrophenoxy)acetyl]-pentyl-amino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[2-(4-nitrophenoxy)-1-oxoethyl]-pentylamino]-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[[2-(4-nitrophenoxy)acetyl]-pentylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-[2-(4-nitrophenoxy)acetyl]amino]-4-methyl-thiazole-5-carboxylic acid ethyl ester Formula: C20H25N3O6S MolecularWeight: 435.494

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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)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(C1=NC(=C(S1)C(=O)OCC)C)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H25N3O6S/c1-4-6-7-12-22(20-21-14(3)18(30-20)19(25)28-5-2)17(24)13-29-16-10-8-15(9-11-16)23(26)27/h8-11H,4-7,12-13H2,1-3H3