N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-3-(1-ethyl-3-methyl-pyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: N-[4-bromanyl-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-3-(1-ethyl-3-methyl-pyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: N-[4-bromo-1-(p-tolylmethyl)pyrazol-3-yl]-3-(1-ethyl-3-methyl-pyrazol-4-yl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: N-[4-bromo-1-[(4-methylphenyl)methyl]-3-pyrazolyl]-3-(1-ethyl-3-methyl-4-pyrazolyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: N-[4-bromo-1-[(4-methylphenyl)methyl]pyrazol-3-yl]-3-(1-ethyl-3-methylpyrazol-4-yl)-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: N-[4-bromo-1-(4-methylbenzyl)pyrazol-3-yl]-3-(1-ethyl-3-methyl-pyrazol-4-yl)-2-isoxazoline-5-carboxamide Formula: C21H23BrN6O2 MolecularWeight: 471.35032

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)C2=NOC(C2)C(=O)NC3=NN(C=C3Br)CC4=CC=C(C=C4)C

Isomeric SMILES

CCN1C=C(C(=N1)C)C2=NOC(C2)C(=O)NC3=NN(C=C3Br)CC4=CC=C(C=C4)C

InChI

InChI=1S/C21H23BrN6O2/c1-4-27-11-16(14(3)24-27)18-9-19(30-26-18)21(29)23-20-17(22)12-28(25-20)10-15-7-5-13(2)6-8-15/h5-8,11-12,19H,4,9-10H2,1-3H3,(H,23,25,29)