2-azanyl-4,4-bis(ethylsulfanyl)-6-(3-fluorophenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile

Systemtic Name: 2-azanyl-4,4-bis(ethylsulfanyl)-6-(3-fluorophenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Openeye Name: 2-amino-4,4-bis(ethylsulfanyl)-6-(3-fluorophenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile CAS Name: 2-amino-4,4-bis(ethylthio)-6-(3-fluorophenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile IUPAC Name: 2-amino-4,4-bis(ethylsulfanyl)-6-(3-fluorophenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Traditional Name: 2-amino-4,4-bis(ethylthio)-6-(3-fluorophenyl)-3-azabicyclo[3.1.0]hex-2-ene-1,5-dicarbonitrile Formula: C17H17FN4S2 MolecularWeight: 360.472083

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1(C2(C(C2(C(=N1)N)C#N)C3=CC(=CC=C3)F)C#N)SCC

Isomeric SMILES

CCSC1(C2(C(C2(C(=N1)N)C#N)C3=CC(=CC=C3)F)C#N)SCC

InChI

InChI=1S/C17H17FN4S2/c1-3-23-17(24-4-2)16(10-20)13(11-6-5-7-12(18)8-11)15(16,9-19)14(21)22-17/h5-8,13H,3-4H2,1-2H3,(H2,21,22)