5-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Openeye Name: N-allyl-5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-N-prop-2-enyl-1,3,4-thiadiazol-2-amine Traditional Name: allyl-[5-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-1,3,4-thiadiazol-2-yl]amine Formula: C14H14ClN3O2S2 MolecularWeight: 355.86286

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=NN=C(S1)SCC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

C=CCNC1=NN=C(S1)SCC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C14H14ClN3O2S2/c1-2-3-16-13-17-18-14(22-13)21-8-9-6-10(15)12-11(7-9)19-4-5-20-12/h2,6-7H,1,3-5,8H2,(H,16,17)