5-(2-methoxyphenyl)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 5-(2-methoxyphenyl)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-oxadiazole-2-thione Openeye Name: 5-(2-methoxyphenyl)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-oxadiazole-2-thione CAS Name: 5-(2-methoxyphenyl)-3-(4-morpholin-4-iumylmethyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 5-(2-methoxyphenyl)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-oxadiazole-2-thione Traditional Name: 5-(2-methoxyphenyl)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-oxadiazole-2-thione Formula: C14H18N3O3S+ MolecularWeight: 308.37602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C(=S)O2)C[NH+]3CCOCC3

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C(=S)O2)C[NH+]3CCOCC3

InChI

InChI=1S/C14H17N3O3S/c1-18-12-5-3-2-4-11(12)13-15-17(14(21)20-13)10-16-6-8-19-9-7-16/h2-5H,6-10H2,1H3/p+1