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

Systemtic Name: methyl 2-[[[(2S)-2-ethylhexanoyl]-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[[(2S)-2-ethylhexanoyl]-isopropyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(2S)-2-ethyl-1-oxohexyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[[(2S)-2-ethylhexanoyl]-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[[(2S)-2-ethylhexanoyl]-isopropyl-amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C17H28N2O3S MolecularWeight: 340.48082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)N(CC1=NC(=CS1)C(=O)OC)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2O3S/c1-6-8-9-13(7-2)16(20)19(12(3)4)10-15-18-14(11-23-15)17(21)22-5/h11-13H,6-10H2,1-5H3/t13-/m0/s1