[3-(4-chlorophenyl)-4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [3-(4-chlorophenyl)-4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [3-(4-chlorophenyl)-4-ethyl-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [3-(4-chlorophenyl)-4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [3-(4-chlorophenyl)-4-ethyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [3-(4-chlorophenyl)-4-ethyl-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-(3-thenyl)ammonium Formula: C17H20ClN4S2+ MolecularWeight: 379.9505

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)C[NH+](C)CC2=CSC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCN1C(=NN(C1=S)C[NH+](C)CC2=CSC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H19ClN4S2/c1-3-21-16(14-4-6-15(18)7-5-14)19-22(17(21)23)12-20(2)10-13-8-9-24-11-13/h4-9,11H,3,10,12H2,1-2H3/p+1