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

Systemtic Name: methyl 2-[[(4-hexylphenyl)carbonyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(4-hexylbenzoyl)-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-hexylphenyl)-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(4-hexylbenzoyl)-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-(4-hexylbenzoyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C24H34N2O3S MolecularWeight: 430.60336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCCC)CC2=NC(=CS2)C(=O)OC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCCC)CC2=NC(=CS2)C(=O)OC

InChI

InChI=1S/C24H34N2O3S/c1-4-6-8-9-11-19-12-14-20(15-13-19)23(27)26(16-10-7-5-2)17-22-25-21(18-30-22)24(28)29-3/h12-15,18H,4-11,16-17H2,1-3H3