4-methyl-2-(morpholin-4-ium-4-ylmethyl)-5-naphthalen-1-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-methyl-2-(morpholin-4-ium-4-ylmethyl)-5-naphthalen-1-yl-1,2,4-triazole-3-thione Openeye Name: 4-methyl-2-(morpholin-4-ium-4-ylmethyl)-5-(1-naphthyl)-1,2,4-triazole-3-thione CAS Name: 4-methyl-2-(4-morpholin-4-iumylmethyl)-5-(1-naphthalenyl)-1,2,4-triazole-3-thione IUPAC Name: 4-methyl-2-(morpholin-4-ium-4-ylmethyl)-5-naphthalen-1-yl-1,2,4-triazole-3-thione Traditional Name: 4-methyl-2-(morpholin-4-ium-4-ylmethyl)-5-(1-naphthyl)-1,2,4-triazole-3-thione Formula: C18H21N4OS+ MolecularWeight: 341.45054

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+]2CCOCC2)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+]2CCOCC2)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C18H20N4OS/c1-20-17(16-8-4-6-14-5-2-3-7-15(14)16)19-22(18(20)24)13-21-9-11-23-12-10-21/h2-8H,9-13H2,1H3/p+1