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

Systemtic Name: methyl 2-[[(3-chloranyl-4-methyl-phenyl)carbamoyl-(3-methylbutyl)amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[(3-chloro-4-methyl-phenyl)carbamoyl-isopentyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(3-chloro-4-methylanilino)-oxomethyl]-(3-methylbutyl)amino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-chloro-4-methylphenyl)carbamoyl-(3-methylbutyl)amino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[(3-chloro-4-methyl-phenyl)carbamoyl-isoamyl-amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C19H24ClN3O4 MolecularWeight: 393.86456

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(CCC(C)C)CC2=NC(=CO2)C(=O)OC)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(CCC(C)C)CC2=NC(=CO2)C(=O)OC)Cl

InChI

InChI=1S/C19H24ClN3O4/c1-12(2)7-8-23(10-17-22-16(11-27-17)18(24)26-4)19(25)21-14-6-5-13(3)15(20)9-14/h5-6,9,11-12H,7-8,10H2,1-4H3,(H,21,25)