4-[2-[3-(5-fluoranyl-2,4-dimethyl-phenyl)-3-oxidanyl-butan-2-yl]-1,3-thiazol-4-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[3-(5-fluoranyl-2,4-dimethyl-phenyl)-3-oxidanyl-butan-2-yl]-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 4-[2-[2-(5-fluoro-2,4-dimethyl-phenyl)-2-hydroxy-1-methyl-propyl]thiazol-4-yl]benzonitrile CAS Name: 4-[2-[3-(5-fluoro-2,4-dimethylphenyl)-3-hydroxybutan-2-yl]-4-thiazolyl]benzonitrile IUPAC Name: 4-[2-[3-(5-fluoro-2,4-dimethylphenyl)-3-hydroxybutan-2-yl]-1,3-thiazol-4-yl]benzonitrile Traditional Name: 4-[2-[2-(5-fluoro-2,4-dimethyl-phenyl)-2-hydroxy-1-methyl-propyl]thiazol-4-yl]benzonitrile Formula: C22H21FN2OS MolecularWeight: 380.478343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(C)(C(C)C2=NC(=CS2)C3=CC=C(C=C3)C#N)O)F)C

Isomeric SMILES

CC1=CC(=C(C=C1C(C)(C(C)C2=NC(=CS2)C3=CC=C(C=C3)C#N)O)F)C

InChI

InChI=1S/C22H21FN2OS/c1-13-9-14(2)19(23)10-18(13)22(4,26)15(3)21-25-20(12-27-21)17-7-5-16(11-24)6-8-17/h5-10,12,15,26H,1-4H3