3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[4-chloranyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]propanamide

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[4-chloranyl-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[4-chloro-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[4-chloro-1-[(4-fluorophenyl)methyl]-3-pyrazolyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[4-chloro-1-[(4-fluorophenyl)methyl]pyrazol-3-yl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[4-chloro-1-(4-fluorobenzyl)pyrazol-3-yl]propionamide Formula: C16H13BrClFN6O3 MolecularWeight: 471.668223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=C(C(=N2)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br)Cl)F

Isomeric SMILES

C1=CC(=CC=C1CN2C=C(C(=N2)NC(=O)CCN3C=C(C(=N3)[N+](=O)[O-])Br)Cl)F

InChI

InChI=1S/C16H13BrClFN6O3/c17-12-8-23(22-16(12)25(27)28)6-5-14(26)20-15-13(18)9-24(21-15)7-10-1-3-11(19)4-2-10/h1-4,8-9H,5-7H2,(H,20,21,26)