3-fluoranyl-4-methyl-N-[3-[(2-methylpropanoylamino)carbamoyl]phenyl]benzenesulfonamide

Systemtic Name: 3-fluoranyl-4-methyl-N-[3-[(2-methylpropanoylamino)carbamoyl]phenyl]benzenesulfonamide Openeye Name: 3-fluoro-4-methyl-N-[3-[(2-methylpropanoylamino)carbamoyl]phenyl]benzenesulfonamide CAS Name: 3-fluoro-4-methyl-N-[3-[[(2-methyl-1-oxopropyl)hydrazo]-oxomethyl]phenyl]benzenesulfonamide IUPAC Name: 3-fluoro-4-methyl-N-[3-[(2-methylpropanoylamino)carbamoyl]phenyl]benzenesulfonamide Traditional Name: 3-fluoro-N-[3-[(isobutyrylamino)carbamoyl]phenyl]-4-methyl-benzenesulfonamide Formula: C18H20FN3O4S MolecularWeight: 393.432503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NNC(=O)C(C)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NNC(=O)C(C)C)F

InChI

InChI=1S/C18H20FN3O4S/c1-11(2)17(23)20-21-18(24)13-5-4-6-14(9-13)22-27(25,26)15-8-7-12(3)16(19)10-15/h4-11,22H,1-3H3,(H,20,23)(H,21,24)