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

Systemtic Name: ethyl 2-[[(4-butylphenyl)carbonyl-(3-ethoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(4-butylbenzoyl)-(3-ethoxypropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-butylphenyl)-oxomethyl]-(3-ethoxypropyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-butylbenzoyl)-(3-ethoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-butylbenzoyl)-(3-ethoxypropyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C23H32N2O4S MolecularWeight: 432.57618

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CCCOCC)CC2=NC(=CS2)C(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CCCOCC)CC2=NC(=CS2)C(=O)OCC

InChI

InChI=1S/C23H32N2O4S/c1-4-7-9-18-10-12-19(13-11-18)22(26)25(14-8-15-28-5-2)16-21-24-20(17-30-21)23(27)29-6-3/h10-13,17H,4-9,14-16H2,1-3H3