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

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O3S/c1-6-8-9-14-25(15-20-24-19(16-29-20)22(27)28-7-2)21(26)17-10-12-18(13-11-17)23(3,4)5/h10-13,16H,6-9,14-15H2,1-5H3