5-(1,3-benzodioxol-5-ylmethyl)-1,3,5-triazinane-2-thione

Systemtic Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3,5-triazinane-2-thione Openeye Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3,5-triazinane-2-thione CAS Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3,5-triazinane-2-thione IUPAC Name: 5-(1,3-benzodioxol-5-ylmethyl)-1,3,5-triazinane-2-thione Traditional Name: 5-piperonyl-1,3,5-triazinane-2-thione Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

C1NC(=S)NCN1CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1NC(=S)NCN1CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C11H13N3O2S/c17-11-12-5-14(6-13-11)4-8-1-2-9-10(3-8)16-7-15-9/h1-3H,4-7H2,(H2,12,13,17)