[(2S)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylate

Systemtic Name: [(2S)-1-(cyclohexylmethylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylate Openeye Name: [(1S)-2-(cyclohexylmethylamino)-1-methyl-2-oxo-ethyl] 4-methyl-2-(2-pyridyl)thiazole-5-carboxylate CAS Name: 4-methyl-2-(2-pyridinyl)-5-thiazolecarboxylic acid [(2S)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(cyclohexylmethylamino)-1-oxopropan-2-yl] 4-methyl-2-pyridin-2-yl-1,3-thiazole-5-carboxylate Traditional Name: 4-methyl-2-(2-pyridyl)thiazole-5-carboxylic acid [(1S)-2-(cyclohexylmethylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)OC(C)C(=O)NCC3CCCCC3

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=CC=N2)C(=O)O[C@@H](C)C(=O)NCC3CCCCC3

InChI

InChI=1S/C20H25N3O3S/c1-13-17(27-19(23-13)16-10-6-7-11-21-16)20(25)26-14(2)18(24)22-12-15-8-4-3-5-9-15/h6-7,10-11,14-15H,3-5,8-9,12H2,1-2H3,(H,22,24)/t14-/m0/s1