methyl 2-[[(3-chloranyl-4-methyl-phenyl)carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(3-chloranyl-4-methyl-phenyl)carbamoyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(3-chloro-4-methyl-phenyl)carbamoyl-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(3-chloro-4-methylanilino)-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-chloro-4-methylphenyl)carbamoyl-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-[(3-chloro-4-methyl-phenyl)carbamoyl]amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C19H24ClN3O3S MolecularWeight: 409.93016

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)NC2=CC(=C(C=C2)C)Cl

Isomeric SMILES

CCCCCN(CC1=NC(=CS1)C(=O)OC)C(=O)NC2=CC(=C(C=C2)C)Cl

InChI

InChI=1S/C19H24ClN3O3S/c1-4-5-6-9-23(11-17-22-16(12-27-17)18(24)26-3)19(25)21-14-8-7-13(2)15(20)10-14/h7-8,10,12H,4-6,9,11H2,1-3H3,(H,21,25)