5-(2,4-dichlorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-4-prop-2-enyl-1,2,4-triazole-3-thione

Systemtic Name: 5-(2,4-dichlorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-4-prop-2-enyl-1,2,4-triazole-3-thione Openeye Name: 4-allyl-5-(2,4-dichlorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 5-(2,4-dichlorophenyl)-2-(4-morpholin-4-iumylmethyl)-4-prop-2-enyl-1,2,4-triazole-3-thione IUPAC Name: 5-(2,4-dichlorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-4-prop-2-enyl-1,2,4-triazole-3-thione Traditional Name: 4-allyl-5-(2,4-dichlorophenyl)-2-(morpholin-4-ium-4-ylmethyl)-1,2,4-triazole-3-thione Formula: C16H19Cl2N4OS+ MolecularWeight: 386.31926

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN(C1=S)C[NH+]2CCOCC2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C=CCN1C(=NN(C1=S)C[NH+]2CCOCC2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H18Cl2N4OS/c1-2-5-21-15(13-4-3-12(17)10-14(13)18)19-22(16(21)24)11-20-6-8-23-9-7-20/h2-4,10H,1,5-9,11H2/p+1