5-[(2-methoxyphenyl)amino]-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione

Systemtic Name: 5-[(2-methoxyphenyl)amino]-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(2-methoxyanilino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-(2-methoxyanilino)-3-(4-morpholin-4-iumylmethyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(2-methoxyanilino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Traditional Name: 3-(morpholin-4-ium-4-ylmethyl)-5-(o-anisidino)-1,3,4-thiadiazole-2-thione Formula: C14H19N4O2S2+ MolecularWeight: 339.45626

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC2=NN(C(=S)S2)C[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=CC=C1NC2=NN(C(=S)S2)C[NH+]3CCOCC3

InChI

InChI=1S/C14H18N4O2S2/c1-19-12-5-3-2-4-11(12)15-13-16-18(14(21)22-13)10-17-6-8-20-9-7-17/h2-5H,6-10H2,1H3,(H,15,16)/p+1