ethyl 2-[[(2,4-dichlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[[(2,4-dichlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[(2,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(2,4-dichloroanilino)-oxomethyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2,4-dichlorophenyl)carbamoyl-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(2,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]thiazole-4-carboxylic acid ethyl ester Formula: C17H19Cl2N3O3S MolecularWeight: 416.32206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C17H19Cl2N3O3S/c1-4-25-16(23)14-9-26-15(20-14)8-22(10(2)3)17(24)21-13-6-5-11(18)7-12(13)19/h5-7,9-10H,4,8H2,1-3H3,(H,21,24)