5-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-N-cyclopropyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-N-cyclopropyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-N-cyclopropyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylthio]-N-cyclopropyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylsulfanyl]-N-cyclopropyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methylthio]-1,3,4-thiadiazol-2-yl]-cyclopropyl-amine Formula: C15H16ClN3O2S2 MolecularWeight: 369.88944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CSC3=NN=C(S3)NC4CC4)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CSC3=NN=C(S3)NC4CC4)Cl)OC1

InChI

InChI=1S/C15H16ClN3O2S2/c16-11-6-9(7-12-13(11)21-5-1-4-20-12)8-22-15-19-18-14(23-15)17-10-2-3-10/h6-7,10H,1-5,8H2,(H,17,18)