[(2R)-3-methyl-1-oxidanylidene-1-(phenethylamino)butan-2-yl] 4,5-bis(chloranyl)-1,2-thiazole-3-carboxylate

Systemtic Name: [(2R)-3-methyl-1-oxidanylidene-1-(phenethylamino)butan-2-yl] 4,5-bis(chloranyl)-1,2-thiazole-3-carboxylate Openeye Name: [(1R)-2-methyl-1-(phenethylcarbamoyl)propyl] 4,5-dichloroisothiazole-3-carboxylate CAS Name: 4,5-dichloro-3-isothiazolecarboxylic acid [(2R)-3-methyl-1-oxo-1-(phenethylamino)butan-2-yl] ester IUPAC Name: [(2R)-3-methyl-1-oxo-1-(phenethylamino)butan-2-yl] 4,5-dichloro-1,2-thiazole-3-carboxylate Traditional Name: 4,5-dichloroisothiazole-3-carboxylic acid [(1R)-2-methyl-1-(phenethylcarbamoyl)propyl] ester Formula: C17H18Cl2N2O3S MolecularWeight: 401.30742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCCC1=CC=CC=C1)OC(=O)C2=NSC(=C2Cl)Cl

Isomeric SMILES

CC(C)[C@H](C(=O)NCCC1=CC=CC=C1)OC(=O)C2=NSC(=C2Cl)Cl

InChI

InChI=1S/C17H18Cl2N2O3S/c1-10(2)14(24-17(23)13-12(18)15(19)25-21-13)16(22)20-9-8-11-6-4-3-5-7-11/h3-7,10,14H,8-9H2,1-2H3,(H,20,22)/t14-/m1/s1