1,3-benzodioxol-5-ylmethyl carbamimidothioate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl carbamimidothioate Openeye Name: 2-(1,3-benzodioxol-5-ylmethyl)isothiourea CAS Name: carbamimidothioic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl carbamimidothioate Traditional Name: 2-piperonylisothiourea Formula: C9H10N2O2S MolecularWeight: 210.2529

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CSC(=N)N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CSC(=N)N

InChI

InChI=1S/C9H10N2O2S/c10-9(11)14-4-6-1-2-7-8(3-6)13-5-12-7/h1-3H,4-5H2,(H3,10,11)