ethyl 2-[(4-methoxy-3-nitro-phenyl)carbonyl-pentyl-amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: ethyl 2-[(4-methoxy-3-nitro-phenyl)carbonyl-pentyl-amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: ethyl 2-[(4-methoxy-3-nitro-benzoyl)-pentyl-amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(4-methoxy-3-nitrophenyl)-oxomethyl]-pentylamino]-4-methyl-5-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-methoxy-3-nitrobenzoyl)-pentylamino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[amyl-(4-methoxy-3-nitro-benzoyl)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)C2=CC(=C(C=C2)OC)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O6S/c1-5-7-8-11-22(20-21-13(3)17(30-20)19(25)29-6-2)18(24)14-9-10-16(28-4)15(12-14)23(26)27/h9-10,12H,5-8,11H2,1-4H3