2,4-bis(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 2,4-bis(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 2,4-bis(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 2,4-bis(4-morpholin-4-iumylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 2,4-bis(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 2,4-bis(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Formula: C12H23N5O2S+2 MolecularWeight: 301.40832

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C=NN(C2=S)C[NH+]3CCOCC3

Isomeric SMILES

C1COCC[NH+]1CN2C=NN(C2=S)C[NH+]3CCOCC3

InChI

InChI=1S/C12H21N5O2S/c20-12-16(10-14-1-5-18-6-2-14)9-13-17(12)11-15-3-7-19-8-4-15/h9H,1-8,10-11H2/p+2