1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea

Systemtic Name: 1-[(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea Openeye Name: [(E)-1,3-benzodioxol-5-ylmethyleneamino]thiourea CAS Name: [(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea IUPAC Name: [(E)-1,3-benzodioxol-5-ylmethylideneamino]thiourea Traditional Name: [(E)-piperonylideneamino]thiourea Formula: C9H9N3O2S MolecularWeight: 223.25166

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=NNC(=S)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=N/NC(=S)N

InChI

InChI=1S/C9H9N3O2S/c10-9(15)12-11-4-6-1-2-7-8(3-6)14-5-13-7/h1-4H,5H2,(H3,10,12,15)/b11-4+