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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[4-(1-piperidylmethyl)phenyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[4-(1-piperidinylmethyl)phenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[4-(piperidin-1-ylmethyl)phenyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[4-(piperidinomethyl)phenyl]-2-furamide Formula: C21H22BrN5O4 MolecularWeight: 488.33448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=O)C3=CC=C(O3)CN4C=C(C(=N4)[N+](=O)[O-])Br

InChI

InChI=1S/C21H22BrN5O4/c22-18-14-26(24-20(18)27(29)30)13-17-8-9-19(31-17)21(28)23-16-6-4-15(5-7-16)12-25-10-2-1-3-11-25/h4-9,14H,1-3,10-13H2,(H,23,28)