7-fluoranyl-2-prop-2-enylsulfanyl-3-(1,2,4-triazol-1-yl)thiochromen-4-one

Systemtic Name: 7-fluoranyl-2-prop-2-enylsulfanyl-3-(1,2,4-triazol-1-yl)thiochromen-4-one Openeye Name: 2-allylsulfanyl-7-fluoro-3-(1,2,4-triazol-1-yl)thiochromen-4-one CAS Name: 7-fluoro-2-(prop-2-enylthio)-3-(1,2,4-triazol-1-yl)-1-benzothiopyran-4-one IUPAC Name: 7-fluoro-2-prop-2-enylsulfanyl-3-(1,2,4-triazol-1-yl)thiochromen-4-one Traditional Name: 2-(allylthio)-7-fluoro-3-(1,2,4-triazol-1-yl)thiochromen-4-one Formula: C14H10FN3OS2 MolecularWeight: 319.377103

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C(=O)C2=C(S1)C=C(C=C2)F)N3C=NC=N3

Isomeric SMILES

C=CCSC1=C(C(=O)C2=C(S1)C=C(C=C2)F)N3C=NC=N3

InChI

InChI=1S/C14H10FN3OS2/c1-2-5-20-14-12(18-8-16-7-17-18)13(19)10-4-3-9(15)6-11(10)21-14/h2-4,6-8H,1,5H2