5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[1-[(3-methylphenyl)methyl]pyrazol-3-yl]furan-2-carboxamide

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[1-[(3-methylphenyl)methyl]pyrazol-3-yl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[1-(m-tolylmethyl)pyrazol-3-yl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[1-[(3-methylphenyl)methyl]-3-pyrazolyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[1-[(3-methylphenyl)methyl]pyrazol-3-yl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[1-(3-methylbenzyl)pyrazol-3-yl]-2-furamide Formula: C20H17BrN6O4 MolecularWeight: 485.29078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2C=CC(=N2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC(=CC=C1)CN2C=CC(=N2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br

InChI

InChI=1S/C20H17BrN6O4/c1-13-3-2-4-14(9-13)10-25-8-7-18(23-25)22-20(28)17-6-5-15(31-17)11-26-12-16(21)19(24-26)27(29)30/h2-9,12H,10-11H2,1H3,(H,22,23,28)