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

Systemtic Name: 5-[(4-ethylphenyl)amino]-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(4-ethylanilino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-(4-ethylanilino)-3-(4-morpholin-4-iumylmethyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(4-ethylanilino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Traditional Name: 5-(4-ethylanilino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Formula: C15H21N4OS2+ MolecularWeight: 337.48344

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=NN(C(=S)S2)C[NH+]3CCOCC3

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=NN(C(=S)S2)C[NH+]3CCOCC3

InChI

InChI=1S/C15H20N4OS2/c1-2-12-3-5-13(6-4-12)16-14-17-19(15(21)22-14)11-18-7-9-20-10-8-18/h3-6H,2,7-11H2,1H3,(H,16,17)/p+1