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

Systemtic Name: methyl 2-[[pentyl-(4-pentylphenyl)carbonyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[pentyl-(4-pentylbenzoyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[oxo-(4-pentylphenyl)methyl]-pentylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[pentyl-(4-pentylbenzoyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-(4-amylbenzoyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C23H32N2O3S MolecularWeight: 416.57678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32N2O3S/c1-4-6-8-10-18-11-13-19(14-12-18)22(26)25(15-9-7-5-2)16-21-24-20(17-29-21)23(27)28-3/h11-14,17H,4-10,15-16H2,1-3H3