[5-(4-chlorophenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-dipropyl-azanium

Systemtic Name: [5-(4-chlorophenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-dipropyl-azanium Openeye Name: [5-(4-chlorophenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-dipropyl-ammonium CAS Name: [5-(4-chlorophenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-dipropylammonium IUPAC Name: [5-(4-chlorophenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-dipropylazanium Traditional Name: [5-(4-chlorophenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-dipropyl-ammonium Formula: C15H22ClN4S+ MolecularWeight: 325.87998

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CN1C(=S)N=C(N1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC[NH+](CCC)CN1C(=S)N=C(N1)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H21ClN4S/c1-3-9-19(10-4-2)11-20-15(21)17-14(18-20)12-5-7-13(16)8-6-12/h5-8H,3-4,9-11H2,1-2H3,(H,17,18,21)/p+1