(6-chloranyl-1,3-benzodioxol-5-yl)methyl N-[bis(azanyl)methylidene]carbamimidothioate

Systemtic Name: (6-chloranyl-1,3-benzodioxol-5-yl)methyl N-[bis(azanyl)methylidene]carbamimidothioate Openeye Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1-(diaminomethylene)isothiourea CAS Name: N-(diaminomethylidene)carbamimidothioic acid (6-chloro-1,3-benzodioxol-5-yl)methyl ester IUPAC Name: (6-chloro-1,3-benzodioxol-5-yl)methyl N-(diaminomethylidene)carbamimidothioate Traditional Name: 2-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-1-(diaminomethylene)isothiourea Formula: C10H11ClN4O2S MolecularWeight: 286.73794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H11ClN4O2S/c11-6-2-8-7(16-4-17-8)1-5(6)3-18-10(14)15-9(12)13/h1-2H,3-4H2,(H5,12,13,14,15)