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

Systemtic Name: 5-[(2-fluorophenyl)amino]-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Openeye Name: 5-(2-fluoroanilino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione CAS Name: 5-(2-fluoroanilino)-3-(4-morpholin-4-iumylmethyl)-1,3,4-thiadiazole-2-thione IUPAC Name: 5-(2-fluoroanilino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Traditional Name: 5-(2-fluoroanilino)-3-(morpholin-4-ium-4-ylmethyl)-1,3,4-thiadiazole-2-thione Formula: C13H16FN4OS2+ MolecularWeight: 327.420743

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CN2C(=S)SC(=N2)NC3=CC=CC=C3F

Isomeric SMILES

C1COCC[NH+]1CN2C(=S)SC(=N2)NC3=CC=CC=C3F

InChI

InChI=1S/C13H15FN4OS2/c14-10-3-1-2-4-11(10)15-12-16-18(13(20)21-12)9-17-5-7-19-8-6-17/h1-4H,5-9H2,(H,15,16)/p+1