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

Systemtic Name: 5-[(4-bromanyl-3-nitro-pyrazol-1-yl)methyl]-N-[2-(4-chlorophenyl)sulfanylphenyl]furan-2-carboxamide Openeye Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[2-(4-chlorophenyl)sulfanylphenyl]furan-2-carboxamide CAS Name: 5-[(4-bromo-3-nitro-1-pyrazolyl)methyl]-N-[2-[(4-chlorophenyl)thio]phenyl]-2-furancarboxamide IUPAC Name: 5-[(4-bromo-3-nitropyrazol-1-yl)methyl]-N-[2-(4-chlorophenyl)sulfanylphenyl]furan-2-carboxamide Traditional Name: 5-[(4-bromo-3-nitro-pyrazol-1-yl)methyl]-N-[2-[(4-chlorophenyl)thio]phenyl]-2-furamide Formula: C21H14BrClN4O4S MolecularWeight: 533.78226

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br)SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)C2=CC=C(O2)CN3C=C(C(=N3)[N+](=O)[O-])Br)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H14BrClN4O4S/c22-16-12-26(25-20(16)27(29)30)11-14-7-10-18(31-14)21(28)24-17-3-1-2-4-19(17)32-15-8-5-13(23)6-9-15/h1-10,12H,11H2,(H,24,28)