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

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-4-cyano-2-fluoranyl-benzamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-4-cyano-2-fluoro-benzamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-cyano-2-fluorobenzamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)-2-methylphenyl]-4-cyano-2-fluorobenzamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]-4-cyano-2-fluoro-benzamide Formula: C22H14FN3OS MolecularWeight: 387.429463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)C2=C(C=C(C=C2)C#N)F)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)C2=C(C=C(C=C2)C#N)F)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H14FN3OS/c1-13-15(22-26-19-6-2-3-8-20(19)28-22)5-4-7-18(13)25-21(27)16-10-9-14(12-24)11-17(16)23/h2-11H,1H3,(H,25,27)