N-[4-bromanyl-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]quinoline-8-sulfonamide

Systemtic Name: N-[4-bromanyl-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]quinoline-8-sulfonamide Openeye Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]quinoline-8-sulfonamide CAS Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]-3-pyrazolyl]-8-quinolinesulfonamide IUPAC Name: N-[4-bromo-1-[(2,4-dichlorophenyl)methyl]pyrazol-3-yl]quinoline-8-sulfonamide Traditional Name: N-[4-bromo-1-(2,4-dichlorobenzyl)pyrazol-3-yl]quinoline-8-sulfonamide Formula: C19H13BrCl2N4O2S MolecularWeight: 512.20712

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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=C(C=C4)Cl)Cl)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)NC3=NN(C=C3Br)CC4=C(C=C(C=C4)Cl)Cl)N=CC=C2

InChI

InChI=1S/C19H13BrCl2N4O2S/c20-15-11-26(10-13-6-7-14(21)9-16(13)22)24-19(15)25-29(27,28)17-5-1-3-12-4-2-8-23-18(12)17/h1-9,11H,10H2,(H,24,25)