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

Systemtic Name: ethyl 2-[[cyclohexyl-[(2S)-2-ethylhexanoyl]amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[cyclohexyl-[(2S)-2-ethylhexanoyl]amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclohexyl-[(2S)-2-ethyl-1-oxohexyl]amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[cyclohexyl-[(2S)-2-ethylhexanoyl]amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclohexyl-[(2S)-2-ethylhexanoyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C21H34N2O3S MolecularWeight: 394.57126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CC1=NC(=CS1)C(=O)OCC)C2CCCCC2

Isomeric SMILES

CCCC[C@H](CC)C(=O)N(CC1=NC(=CS1)C(=O)OCC)C2CCCCC2

InChI

InChI=1S/C21H34N2O3S/c1-4-7-11-16(5-2)20(24)23(17-12-9-8-10-13-17)14-19-22-18(15-27-19)21(25)26-6-3/h15-17H,4-14H2,1-3H3/t16-/m0/s1