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

Systemtic Name: methyl 2-[[3-methylbutyl-[(4-methylphenyl)carbamoyl]amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[isopentyl(p-tolylcarbamoyl)amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(4-methylanilino)-oxomethyl]-(3-methylbutyl)amino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[3-methylbutyl-[(4-methylphenyl)carbamoyl]amino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[isoamyl(p-tolylcarbamoyl)amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C19H25N3O4 MolecularWeight: 359.4195

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O4/c1-13(2)9-10-22(11-17-21-16(12-26-17)18(23)25-4)19(24)20-15-7-5-14(3)6-8-15/h5-8,12-13H,9-11H2,1-4H3,(H,20,24)