5-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-cyclohexyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-cyclohexyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-cyclohexyl-1,3,4-thiadiazol-2-amine CAS Name: 5-(1,3-benzodioxol-5-ylmethylthio)-N-cyclohexyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(1,3-benzodioxol-5-ylmethylsulfanyl)-N-cyclohexyl-1,3,4-thiadiazol-2-amine Traditional Name: cyclohexyl-[5-(piperonylthio)-1,3,4-thiadiazol-2-yl]amine Formula: C16H19N3O2S2 MolecularWeight: 349.47096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NN=C(S2)SCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCC(CC1)NC2=NN=C(S2)SCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H19N3O2S2/c1-2-4-12(5-3-1)17-15-18-19-16(23-15)22-9-11-6-7-13-14(8-11)21-10-20-13/h6-8,12H,1-5,9-10H2,(H,17,18)