4-cyclopropyl-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-cyclopropyl-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione Openeye Name: 4-cyclopropyl-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)-1,2,4-triazole-3-thione CAS Name: 4-cyclopropyl-2-(4-morpholin-4-iumylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione IUPAC Name: 4-cyclopropyl-2-(morpholin-4-ium-4-ylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione Traditional Name: 4-cyclopropyl-2-(morpholin-4-ium-4-ylmethyl)-5-(2-thienyl)-1,2,4-triazole-3-thione Formula: C14H19N4OS2+ MolecularWeight: 323.45686

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN(C2=S)C[NH+]3CCOCC3)C4=CC=CS4

Isomeric SMILES

C1CC1N2C(=NN(C2=S)C[NH+]3CCOCC3)C4=CC=CS4

InChI

InChI=1S/C14H18N4OS2/c20-14-17(10-16-5-7-19-8-6-16)15-13(12-2-1-9-21-12)18(14)11-3-4-11/h1-2,9,11H,3-8,10H2/p+1