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

Systemtic Name: methyl 2-[[(4-tert-butylphenyl)carbonyl-(3-ethoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(4-tert-butylbenzoyl)-(3-ethoxypropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-tert-butylphenyl)-oxomethyl]-(3-ethoxypropyl)amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-tert-butylbenzoyl)-(3-ethoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-tert-butylbenzoyl)-(3-ethoxypropyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C22H30N2O4S MolecularWeight: 418.5496

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCOCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C22H30N2O4S/c1-6-28-13-7-12-24(14-19-23-18(15-29-19)21(26)27-5)20(25)16-8-10-17(11-9-16)22(2,3)4/h8-11,15H,6-7,12-14H2,1-5H3