N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]quinoline-8-sulfonamide

Systemtic Name: N-[4-bromanyl-1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrazol-3-yl]quinoline-8-sulfonamide Openeye Name: N-[4-bromo-1-[(2-chloro-6-fluoro-phenyl)methyl]pyrazol-3-yl]quinoline-8-sulfonamide CAS Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-3-pyrazolyl]-8-quinolinesulfonamide IUPAC Name: N-[4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]pyrazol-3-yl]quinoline-8-sulfonamide Traditional Name: N-[4-bromo-1-(2-chloro-6-fluoro-benzyl)pyrazol-3-yl]quinoline-8-sulfonamide Formula: C19H13BrClFN4O2S MolecularWeight: 495.752523

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)NC3=NN(C=C3Br)CC4=C(C=CC=C4Cl)F)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)NC3=NN(C=C3Br)CC4=C(C=CC=C4Cl)F)N=CC=C2

InChI

InChI=1S/C19H13BrClFN4O2S/c20-14-11-26(10-13-15(21)6-2-7-16(13)22)24-19(14)25-29(27,28)17-8-1-4-12-5-3-9-23-18(12)17/h1-9,11H,10H2,(H,24,25)