N3,N8-bis(4-fluorophenyl)-5,6-dihydro-1,2,4,7-dithiadiazocine-3,8-diamine

Systemtic Name: N3,N8-bis(4-fluorophenyl)-5,6-dihydro-1,2,4,7-dithiadiazocine-3,8-diamine Openeye Name: N3,N8-bis(4-fluorophenyl)-5,6-dihydro-1,2,4,7-dithiadiazocine-3,8-diamine CAS Name: N3,N8-bis(4-fluorophenyl)-5,6-dihydro-1,2,4,7-dithiadiazocine-3,8-diamine IUPAC Name: 3-N,8-N-bis(4-fluorophenyl)-5,6-dihydro-1,2,4,7-dithiadiazocine-3,8-diamine Traditional Name: [8-(4-fluoroanilino)-5,6-dihydro-1,2,4,7-dithiadiazocin-3-yl]-(4-fluorophenyl)amine Formula: C16H14F2N4S2 MolecularWeight: 364.435966

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(SSC(=N1)NC2=CC=C(C=C2)F)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CN=C(SSC(=N1)NC2=CC=C(C=C2)F)NC3=CC=C(C=C3)F

InChI

InChI=1S/C16H14F2N4S2/c17-11-1-5-13(6-2-11)21-15-19-9-10-20-16(24-23-15)22-14-7-3-12(18)4-8-14/h1-8H,9-10H2,(H,19,21)(H,20,22)