N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-5-methyl-4-[(4-nitropyrazol-1-yl)methyl]-1,2-oxazole-3-carboxamide

Systemtic Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-5-methyl-4-[(4-nitropyrazol-1-yl)methyl]-1,2-oxazole-3-carboxamide Openeye Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-5-methyl-4-[(4-nitropyrazol-1-yl)methyl]isoxazole-3-carboxamide CAS Name: N-[1-[(4-bromophenyl)methyl]-3-pyrazolyl]-5-methyl-4-[(4-nitro-1-pyrazolyl)methyl]-3-isoxazolecarboxamide IUPAC Name: N-[1-[(4-bromophenyl)methyl]pyrazol-3-yl]-5-methyl-4-[(4-nitropyrazol-1-yl)methyl]-1,2-oxazole-3-carboxamide Traditional Name: N-[1-(4-bromobenzyl)pyrazol-3-yl]-5-methyl-4-[(4-nitropyrazol-1-yl)methyl]isoxazole-3-carboxamide Formula: C19H16BrN7O4 MolecularWeight: 486.27884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C(=O)NC2=NN(C=C2)CC3=CC=C(C=C3)Br)CN4C=C(C=N4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C(=O)NC2=NN(C=C2)CC3=CC=C(C=C3)Br)CN4C=C(C=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H16BrN7O4/c1-12-16(11-26-10-15(8-21-26)27(29)30)18(24-31-12)19(28)22-17-6-7-25(23-17)9-13-2-4-14(20)5-3-13/h2-8,10H,9,11H2,1H3,(H,22,23,28)