[3-(5-bromanyl-1,3-thiazol-2-yl)-2-(2-chloroethyl)-3-oxidanidyl-imidazolidin-3-ium-4-yl] 5-chloranyl-4-methyl-pyridine-2-carboxylate

Systemtic Name: [3-(5-bromanyl-1,3-thiazol-2-yl)-2-(2-chloroethyl)-3-oxidanidyl-imidazolidin-3-ium-4-yl] 5-chloranyl-4-methyl-pyridine-2-carboxylate Openeye Name: [3-(5-bromothiazol-2-yl)-2-(2-chloroethyl)-3-oxido-imidazolidin-3-ium-4-yl] 5-chloro-4-methyl-pyridine-2-carboxylate CAS Name: 5-chloro-4-methyl-2-pyridinecarboxylic acid [3-(5-bromo-2-thiazolyl)-2-(2-chloroethyl)-3-oxido-4-imidazolidin-3-iumyl] ester IUPAC Name: [3-(5-bromo-1,3-thiazol-2-yl)-2-(2-chloroethyl)-3-oxidoimidazolidin-3-ium-4-yl] 5-chloro-4-methylpyridine-2-carboxylate Traditional Name: 5-chloro-4-methyl-picolinic acid [3-(5-bromothiazol-2-yl)-2-(2-chloroethyl)-3-oxido-imidazolidin-3-ium-4-yl] ester Formula: C15H15BrCl2N4O3S MolecularWeight: 482.1796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1Cl)C(=O)OC2CNC([N+]2(C3=NC=C(S3)Br)[O-])CCCl

Isomeric SMILES

CC1=CC(=NC=C1Cl)C(=O)OC2CNC([N+]2(C3=NC=C(S3)Br)[O-])CCCl

InChI

InChI=1S/C15H15BrCl2N4O3S/c1-8-4-10(19-5-9(8)18)14(23)25-13-7-20-12(2-3-17)22(13,24)15-21-6-11(16)26-15/h4-6,12-13,20H,2-3,7H2,1H3