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

Systemtic Name: methyl 2-[[(3-chloranyl-4-methyl-phenyl)carbamoyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[(3-chloro-4-methyl-phenyl)carbamoyl-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(3-chloro-4-methylanilino)-oxomethyl]-(3-methoxypropyl)amino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-chloro-4-methylphenyl)carbamoyl-(3-methoxypropyl)amino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[(3-chloro-4-methyl-phenyl)carbamoyl-(3-methoxypropyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C18H22ClN3O4S MolecularWeight: 411.90298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(CCCOC)CC2=NC(=CS2)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(CCCOC)CC2=NC(=CS2)C(=O)OC)Cl

InChI

InChI=1S/C18H22ClN3O4S/c1-12-5-6-13(9-14(12)19)20-18(24)22(7-4-8-25-2)10-16-21-15(11-27-16)17(23)26-3/h5-6,9,11H,4,7-8,10H2,1-3H3,(H,20,24)