methyl 2-[[(3,4-dichlorophenyl)carbonyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(3,4-dichlorophenyl)carbonyl-pentyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(3,4-dichlorobenzoyl)-pentyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(3,4-dichlorophenyl)-oxomethyl]-pentylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(3,4-dichlorobenzoyl)-pentylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[amyl-(3,4-dichlorobenzoyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C18H20Cl2N2O3S MolecularWeight: 415.334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20Cl2N2O3S/c1-3-4-5-8-22(10-16-21-15(11-26-16)18(24)25-2)17(23)12-6-7-13(19)14(20)9-12/h6-7,9,11H,3-5,8,10H2,1-2H3