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

Systemtic Name: 5-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C11H10ClN3O2S2 MolecularWeight: 315.799

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC(=CC(=C2OCO1)CSC3=NN=C(S3)N)Cl

Isomeric SMILES

C1C2=CC(=CC(=C2OCO1)CSC3=NN=C(S3)N)Cl

InChI

InChI=1S/C11H10ClN3O2S2/c12-8-1-6-3-16-5-17-9(6)7(2-8)4-18-11-15-14-10(13)19-11/h1-2H,3-5H2,(H2,13,14)