1-(2,1,3-benzoxadiazol-5-ylcarbonylamino)-3-methyl-thiourea

Systemtic Name: 1-(2,1,3-benzoxadiazol-5-ylcarbonylamino)-3-methyl-thiourea Openeye Name: 1-(2,1,3-benzoxadiazole-5-carbonylamino)-3-methyl-thiourea CAS Name: 1-[[2,1,3-benzoxadiazol-5-yl(oxo)methyl]amino]-3-methylthiourea IUPAC Name: 1-(2,1,3-benzoxadiazole-5-carbonylamino)-3-methylthiourea Traditional Name: 1-(benzofurazan-5-carbonylamino)-3-methyl-thiourea Formula: C9H9N5O2S MolecularWeight: 251.26506

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)C1=CC2=NON=C2C=C1

Isomeric SMILES

CNC(=S)NNC(=O)C1=CC2=NON=C2C=C1

InChI

InChI=1S/C9H9N5O2S/c1-10-9(17)12-11-8(15)5-2-3-6-7(4-5)14-16-13-6/h2-4H,1H3,(H,11,15)(H2,10,12,17)