ethyl 2-[[cyclohexyl-[(3R)-3,5,5-trimethylhexanoyl]amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[cyclohexyl-[(3R)-3,5,5-trimethylhexanoyl]amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[cyclohexyl-[(3R)-3,5,5-trimethylhexanoyl]amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[cyclohexyl-[(3R)-3,5,5-trimethyl-1-oxohexyl]amino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[cyclohexyl-[(3R)-3,5,5-trimethylhexanoyl]amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[cyclohexyl-[(3R)-3,5,5-trimethylhexanoyl]amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C22H36N2O3S MolecularWeight: 408.59784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C2CCCCC2)C(=O)C[C@H](C)CC(C)(C)C

InChI

InChI=1S/C22H36N2O3S/c1-6-27-21(26)18-15-28-19(23-18)14-24(17-10-8-7-9-11-17)20(25)12-16(2)13-22(3,4)5/h15-17H,6-14H2,1-5H3/t16-/m0/s1