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(6-chloranyl-1,3-benzodioxol-5-yl)methyl carbamimidothioate

(6-chloranyl-1,3-benzodioxol-5-yl)methyl carbamimidothioate

Systemtic Name:(6-chloranyl-1,3-benzodioxol-5-yl)methyl carbamimidothioate
Openeye Name:2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]isothiourea
CAS Name:carbamimidothioic acid (6-chloro-1,3-benzodioxol-5-yl)methyl ester
IUPAC Name:(6-chloro-1,3-benzodioxol-5-yl)methyl carbamimidothioate
Traditional Name:2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]isothiourea
Formula: C9H9ClN2O2S
MolecularWeight: 244.69796
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H9ClN2O2S/c10-6-2-8-7(13-4-14-8)1-5(6)3-15-9(11)12/h1-2H,3-4H2,(H3,11,12)


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