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

Systemtic Name: ethyl 2-[[cyclohexyl-(4-ethylphenyl)carbonyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[cyclohexyl-(4-ethylbenzoyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclohexyl-[(4-ethylphenyl)-oxomethyl]amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[cyclohexyl-(4-ethylbenzoyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclohexyl-(4-ethylbenzoyl)amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)OCC)C3CCCCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N(CC2=NC(=CS2)C(=O)OCC)C3CCCCC3

InChI

InChI=1S/C22H28N2O3S/c1-3-16-10-12-17(13-11-16)21(25)24(18-8-6-5-7-9-18)14-20-23-19(15-28-20)22(26)27-4-2/h10-13,15,18H,3-9,14H2,1-2H3