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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C3=NN=C(SC3)NC4=CC=CC=C4F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C3=NN=C(SC3)NC4=CC=CC=C4F)OC1

InChI

InChI=1S/C18H16FN3O2S/c19-13-4-1-2-5-14(13)20-18-22-21-15(11-25-18)12-6-7-16-17(10-12)24-9-3-8-23-16/h1-2,4-7,10H,3,8-9,11H2,(H,20,22)