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

Systemtic Name: methyl 2-[[tert-butyl-(4-butylphenyl)carbonyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[tert-butyl-(4-butylbenzoyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[tert-butyl-[(4-butylphenyl)-oxomethyl]amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[tert-butyl-(4-butylbenzoyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[tert-butyl-(4-butylbenzoyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O3S/c1-6-7-8-15-9-11-16(12-10-15)19(24)23(21(2,3)4)13-18-22-17(14-27-18)20(25)26-5/h9-12,14H,6-8,13H2,1-5H3