2-[5-[2,4-bis(fluoranyl)phenyl]-1-methyl-2-oxidanylidene-1-[3-(1,2,4-triazol-1-yl)propyl]-3H-1,3-thiazol-4-yl]benzenecarbonitrile

Systemtic Name: 2-[5-[2,4-bis(fluoranyl)phenyl]-1-methyl-2-oxidanylidene-1-[3-(1,2,4-triazol-1-yl)propyl]-3H-1,3-thiazol-4-yl]benzenecarbonitrile Openeye Name: 2-[5-(2,4-difluorophenyl)-1-methyl-2-oxo-1-[3-(1,2,4-triazol-1-yl)propyl]-3H-thiazol-4-yl]benzonitrile CAS Name: 2-[5-(2,4-difluorophenyl)-1-methyl-2-oxo-1-[3-(1,2,4-triazol-1-yl)propyl]-3H-thiazol-4-yl]benzonitrile IUPAC Name: 2-[5-(2,4-difluorophenyl)-1-methyl-2-oxo-1-[3-(1,2,4-triazol-1-yl)propyl]-3H-1,3-thiazol-4-yl]benzonitrile Traditional Name: 2-[5-(2,4-difluorophenyl)-2-keto-1-methyl-1-[3-(1,2,4-triazol-1-yl)propyl]-3H-thiazol-4-yl]benzonitrile Formula: C22H19F2N5OS MolecularWeight: 439.480966

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Descriptors Computed from Structure

Canonical SMILES:

CS1(C(=C(NC1=O)C2=CC=CC=C2C#N)C3=C(C=C(C=C3)F)F)CCCN4C=NC=N4

Isomeric SMILES

CS1(C(=C(NC1=O)C2=CC=CC=C2C#N)C3=C(C=C(C=C3)F)F)CCCN4C=NC=N4

InChI

InChI=1S/C22H19F2N5OS/c1-31(10-4-9-29-14-26-13-27-29)21(18-8-7-16(23)11-19(18)24)20(28-22(31)30)17-6-3-2-5-15(17)12-25/h2-3,5-8,11,13-14H,4,9-10H2,1H3,(H,28,30)