5-(1,3-benzodioxol-5-yl)-N-cyclohexyl-3-methyl-1,3,4-thiadiazol-2-imine

Systemtic Name: 5-(1,3-benzodioxol-5-yl)-N-cyclohexyl-3-methyl-1,3,4-thiadiazol-2-imine Openeye Name: 5-(1,3-benzodioxol-5-yl)-N-cyclohexyl-3-methyl-1,3,4-thiadiazol-2-imine CAS Name: 5-(1,3-benzodioxol-5-yl)-N-cyclohexyl-3-methyl-1,3,4-thiadiazol-2-imine IUPAC Name: 5-(1,3-benzodioxol-5-yl)-N-cyclohexyl-3-methyl-1,3,4-thiadiazol-2-imine Traditional Name: [5-(1,3-benzodioxol-5-yl)-3-methyl-1,3,4-thiadiazol-2-ylidene]-cyclohexyl-amine Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2CCCCC2)SC(=N1)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CN1C(=NC2CCCCC2)SC(=N1)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C16H19N3O2S/c1-19-16(17-12-5-3-2-4-6-12)22-15(18-19)11-7-8-13-14(9-11)21-10-20-13/h7-9,12H,2-6,10H2,1H3