2-[(3-chloranyl-4-methyl-phenyl)carbamoyl-(3-methylbutyl)amino]-N-(1,2-oxazol-3-yl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-methyl-phenyl)carbamoyl-(3-methylbutyl)amino]-N-(1,2-oxazol-3-yl)ethanamide Openeye Name: 2-[(3-chloro-4-methyl-phenyl)carbamoyl-isopentyl-amino]-N-isoxazol-3-yl-acetamide CAS Name: 2-[[(3-chloro-4-methylanilino)-oxomethyl]-(3-methylbutyl)amino]-N-(3-isoxazolyl)acetamide IUPAC Name: 2-[(3-chloro-4-methylphenyl)carbamoyl-(3-methylbutyl)amino]-N-(1,2-oxazol-3-yl)acetamide Traditional Name: 2-[(3-chloro-4-methyl-phenyl)carbamoyl-isoamyl-amino]-N-isoxazol-3-yl-acetamide Formula: C18H23ClN4O3 MolecularWeight: 378.85322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(CCC(C)C)CC(=O)NC2=NOC=C2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(CCC(C)C)CC(=O)NC2=NOC=C2)Cl

InChI

InChI=1S/C18H23ClN4O3/c1-12(2)6-8-23(11-17(24)21-16-7-9-26-22-16)18(25)20-14-5-4-13(3)15(19)10-14/h4-5,7,9-10,12H,6,8,11H2,1-3H3,(H,20,25)(H,21,22,24)