5-(6-methoxy-1-oxidanyl-2,3,1-benzodiazaborinin-2-yl)-1,2-dihydro-1,2,4-triazole-3-thione

Systemtic Name: 5-(6-methoxy-1-oxidanyl-2,3,1-benzodiazaborinin-2-yl)-1,2-dihydro-1,2,4-triazole-3-thione Openeye Name: 5-(1-hydroxy-6-methoxy-2,3,1-benzodiazaborinin-2-yl)-1,2-dihydro-1,2,4-triazole-3-thione CAS Name: 5-(1-hydroxy-6-methoxy-2,3,1-benzodiazaborin-2-yl)-1,2-dihydro-1,2,4-triazole-3-thione IUPAC Name: 5-(1-hydroxy-6-methoxy-2,3,1-benzodiazaborinin-2-yl)-1,2-dihydro-1,2,4-triazole-3-thione Traditional Name: 5-(1-hydroxy-6-methoxy-2,3,1-benzodiazaborin-2-yl)-1,2-dihydro-1,2,4-triazole-3-thione Formula: C10H10BN5O2S MolecularWeight: 275.0947

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Descriptors Computed from Structure

Canonical SMILES:

B1(C2=C(C=C(C=C2)OC)C=NN1C3=NC(=S)NN3)O

Isomeric SMILES

B1(C2=C(C=C(C=C2)OC)C=NN1C3=NC(=S)NN3)O

InChI

InChI=1S/C10H10BN5O2S/c1-18-7-2-3-8-6(4-7)5-12-16(11(8)17)9-13-10(19)15-14-9/h2-5,17H,1H3,(H2,13,14,15,19)