methyl 2-[[(4-pentylphenyl)carbonyl-propyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(4-pentylphenyl)carbonyl-propyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(4-pentylbenzoyl)-propyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[oxo-(4-pentylphenyl)methyl]-propylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-pentylbenzoyl)-propylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-amylbenzoyl)-propyl-amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCC)CC2=NC(=CS2)C(=O)OC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCC)CC2=NC(=CS2)C(=O)OC

InChI

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