1-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-3-(2,5-dimethylphenyl)urea

Systemtic Name: 1-[(3-bromanyl-4,5-dihydro-1,2-oxazol-5-yl)methyl]-3-(2,5-dimethylphenyl)urea Openeye Name: 1-[(3-bromo-4,5-dihydroisoxazol-5-yl)methyl]-3-(2,5-dimethylphenyl)urea CAS Name: 1-[(3-bromo-4,5-dihydroisoxazol-5-yl)methyl]-3-(2,5-dimethylphenyl)urea IUPAC Name: 1-[(3-bromo-4,5-dihydro-1,2-oxazol-5-yl)methyl]-3-(2,5-dimethylphenyl)urea Traditional Name: 1-[(3-bromo-2-isoxazolin-5-yl)methyl]-3-(2,5-dimethylphenyl)urea Formula: C13H16BrN3O2 MolecularWeight: 326.18904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)NCC2CC(=NO2)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)NCC2CC(=NO2)Br

InChI

InChI=1S/C13H16BrN3O2/c1-8-3-4-9(2)11(5-8)16-13(18)15-7-10-6-12(14)17-19-10/h3-5,10H,6-7H2,1-2H3,(H2,15,16,18)