4-[[5-azanyl-1-(2-chloranyl-6-fluoranyl-3-methyl-phenyl)carbonyl-1,2,4-triazol-3-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[5-azanyl-1-(2-chloranyl-6-fluoranyl-3-methyl-phenyl)carbonyl-1,2,4-triazol-3-yl]amino]benzenesulfonamide Openeye Name: 4-[[5-amino-1-(2-chloro-6-fluoro-3-methyl-benzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide CAS Name: 4-[[5-amino-1-[(2-chloro-6-fluoro-3-methylphenyl)-oxomethyl]-1,2,4-triazol-3-yl]amino]benzenesulfonamide IUPAC Name: 4-[[5-amino-1-(2-chloro-6-fluoro-3-methylbenzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Traditional Name: 4-[[5-amino-1-(2-chloro-6-fluoro-3-methyl-benzoyl)-1,2,4-triazol-3-yl]amino]benzenesulfonamide Formula: C16H14ClFN6O3S MolecularWeight: 424.837163

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)F)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)F)C(=O)N2C(=NC(=N2)NC3=CC=C(C=C3)S(=O)(=O)N)N)Cl

InChI

InChI=1S/C16H14ClFN6O3S/c1-8-2-7-11(18)12(13(8)17)14(25)24-15(19)22-16(23-24)21-9-3-5-10(6-4-9)28(20,26)27/h2-7H,1H3,(H2,20,26,27)(H3,19,21,22,23)