ethyl 2-[[(4-butylphenyl)carbonyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(4-butylphenyl)carbonyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(4-butylbenzoyl)-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-butylphenyl)-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-butylbenzoyl)-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-(4-butylbenzoyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C23H32N2O3S MolecularWeight: 416.57678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)C2=CC=C(C=C2)CCCC

Isomeric SMILES

CCCCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)C2=CC=C(C=C2)CCCC

InChI

InChI=1S/C23H32N2O3S/c1-4-7-9-15-25(16-21-24-20(17-29-21)23(27)28-6-3)22(26)19-13-11-18(12-14-19)10-8-5-2/h11-14,17H,4-10,15-16H2,1-3H3