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

Systemtic Name: ethyl 2-[[(4-hexylphenyl)carbonyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(4-hexylbenzoyl)-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(4-hexylphenyl)-oxomethyl]-(3-methoxypropyl)amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(4-hexylbenzoyl)-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(4-hexylbenzoyl)-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C24H34N2O4S MolecularWeight: 446.60276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCOC)CC2=NC(=CS2)C(=O)OCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N(CCCOC)CC2=NC(=CS2)C(=O)OCC

InChI

InChI=1S/C24H34N2O4S/c1-4-6-7-8-10-19-11-13-20(14-12-19)23(27)26(15-9-16-29-3)17-22-25-21(18-31-22)24(28)30-5-2/h11-14,18H,4-10,15-17H2,1-3H3