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

Systemtic Name: ethyl 2-[[(3,4-dichlorophenyl)carbonyl-propyl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(3,4-dichlorobenzoyl)-propyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(3,4-dichlorophenyl)-oxomethyl]-propylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(3,4-dichlorobenzoyl)-propylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(3,4-dichlorobenzoyl)-propyl-amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C17H18Cl2N2O3S MolecularWeight: 401.30742

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H18Cl2N2O3S/c1-3-7-21(16(22)11-5-6-12(18)13(19)8-11)9-15-20-14(10-25-15)17(23)24-4-2/h5-6,8,10H,3-4,7,9H2,1-2H3