N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-3-fluoranyl-4-methyl-benzenesulfonamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-3-fluoranyl-4-methyl-benzenesulfonamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-3-fluoro-4-methyl-benzenesulfonamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-fluoro-4-methylbenzenesulfonamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-2-methylphenyl]-3-fluoro-4-methylbenzenesulfonamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-3-fluoro-4-methyl-benzenesulfonamide Formula: C21H17FN2O2S2 MolecularWeight: 412.500283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C3=NC4=CC=CC=C4S3)C)F

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C3=NC4=CC=CC=C4S3)C)F

InChI

InChI=1S/C21H17FN2O2S2/c1-13-7-9-16(12-17(13)22)28(25,26)24-18-10-8-15(11-14(18)2)21-23-19-5-3-4-6-20(19)27-21/h3-12,24H,1-2H3