5-(2-chlorophenyl)-4-cyclopentyl-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 5-(2-chlorophenyl)-4-cyclopentyl-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 5-(2-chlorophenyl)-4-cyclopentyl-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 5-(2-chlorophenyl)-4-cyclopentyl-2-(4-morpholin-4-iumylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 5-(2-chlorophenyl)-4-cyclopentyl-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 5-(2-chlorophenyl)-4-cyclopentyl-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Formula: C18H24ClN4OS+ MolecularWeight: 379.92736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2C(=NN(C2=S)C[NH+]3CCOCC3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(C1)N2C(=NN(C2=S)C[NH+]3CCOCC3)C4=CC=CC=C4Cl

InChI

InChI=1S/C18H23ClN4OS/c19-16-8-4-3-7-15(16)17-20-22(13-21-9-11-24-12-10-21)18(25)23(17)14-5-1-2-6-14/h3-4,7-8,14H,1-2,5-6,9-13H2/p+1