5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-fluorophenyl)-6H-1,3,4-thiadiazin-2-amine

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-fluorophenyl)-6H-1,3,4-thiadiazin-2-amine Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-fluorophenyl)-6H-1,3,4-thiadiazin-2-amine CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-fluorophenyl)-6H-1,3,4-thiadiazin-2-amine IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-(4-fluorophenyl)-6H-1,3,4-thiadiazin-2-amine Traditional Name: [5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-6H-1,3,4-thiadiazin-2-yl]-(4-fluorophenyl)amine Formula: C18H16FN3O2S MolecularWeight: 357.401943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C3=NN=C(SC3)NC4=CC=C(C=C4)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C3=NN=C(SC3)NC4=CC=C(C=C4)F)OC1

InChI

InChI=1S/C18H16FN3O2S/c19-13-3-5-14(6-4-13)20-18-22-21-15(11-25-18)12-2-7-16-17(10-12)24-9-1-8-23-16/h2-7,10H,1,8-9,11H2,(H,20,22)