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

Systemtic Name: methyl 2-[[(3-cyanophenyl)carbamoyl-(3-methylbutyl)amino]methyl]-1,3-oxazole-4-carboxylate Openeye Name: methyl 2-[[(3-cyanophenyl)carbamoyl-isopentyl-amino]methyl]oxazole-4-carboxylate CAS Name: 2-[[[(3-cyanoanilino)-oxomethyl]-(3-methylbutyl)amino]methyl]-4-oxazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-cyanophenyl)carbamoyl-(3-methylbutyl)amino]methyl]-1,3-oxazole-4-carboxylate Traditional Name: 2-[[(3-cyanophenyl)carbamoyl-isoamyl-amino]methyl]oxazole-4-carboxylic acid methyl ester Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CC1=NC(=CO1)C(=O)OC)C(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CC(C)CCN(CC1=NC(=CO1)C(=O)OC)C(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C19H22N4O4/c1-13(2)7-8-23(11-17-22-16(12-27-17)18(24)26-3)19(25)21-15-6-4-5-14(9-15)10-20/h4-6,9,12-13H,7-8,11H2,1-3H3,(H,21,25)