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

Systemtic Name: 5-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N-isobutyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-N-(2-methylpropyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazol-2-yl]-isobutyl-amine Formula: C15H18ClN3O2S2 MolecularWeight: 371.90532

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NN=C(S1)SCC2=C3C(=CC(=C2)Cl)COCO3

Isomeric SMILES

CC(C)CNC1=NN=C(S1)SCC2=C3C(=CC(=C2)Cl)COCO3

InChI

InChI=1S/C15H18ClN3O2S2/c1-9(2)5-17-14-18-19-15(23-14)22-7-11-4-12(16)3-10-6-20-8-21-13(10)11/h3-4,9H,5-8H2,1-2H3,(H,17,18)