N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-2-cyano-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-2-cyano-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enamide CAS Name: 2-cyano-N-[4-(difluoromethylthio)phenyl]-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propenamide IUPAC Name: 2-cyano-N-[4-(difluoromethylsulfanyl)phenyl]-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enamide Traditional Name: 2-cyano-N-[4-(difluoromethylthio)phenyl]-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acrylamide Formula: C24H16F2N4OS2 MolecularWeight: 478.536846

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=C(C#N)C(=O)NC4=CC=C(C=C4)SC(F)F

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=C(C#N)C(=O)NC4=CC=C(C=C4)SC(F)F

InChI

InChI=1S/C24H16F2N4OS2/c25-24(26)33-20-10-8-18(9-11-20)28-23(31)16(14-27)13-17-15-30(19-5-2-1-3-6-19)29-22(17)21-7-4-12-32-21/h1-13,15,24H,(H,28,31)