N-[4-[bis(fluoranyl)methoxy]phenyl]-5-chloranyl-2-prop-2-enylsulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]phenyl]-5-chloranyl-2-prop-2-enylsulfanyl-pyrimidine-4-carboxamide Openeye Name: 2-allylsulfanyl-5-chloro-N-[4-(difluoromethoxy)phenyl]pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[4-(difluoromethoxy)phenyl]-2-(prop-2-enylthio)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[4-(difluoromethoxy)phenyl]-2-prop-2-enylsulfanylpyrimidine-4-carboxamide Traditional Name: 2-(allylthio)-5-chloro-N-[4-(difluoromethoxy)phenyl]pyrimidine-4-carboxamide Formula: C15H12ClF2N3O2S MolecularWeight: 371.789486

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)OC(F)F)Cl

Isomeric SMILES

C=CCSC1=NC=C(C(=N1)C(=O)NC2=CC=C(C=C2)OC(F)F)Cl

InChI

InChI=1S/C15H12ClF2N3O2S/c1-2-7-24-15-19-8-11(16)12(21-15)13(22)20-9-3-5-10(6-4-9)23-14(17)18/h2-6,8,14H,1,7H2,(H,20,22)