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

Systemtic Name: [5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [5-(4-ethylphenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [5-(4-ethylphenyl)-3-sulfanylidene-1H-1,2,4-triazol-2-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [5-(4-ethylphenyl)-3-thioxo-1H-1,2,4-triazol-2-yl]methyl-methyl-(3-thenyl)ammonium Formula: C17H21N4S2+ MolecularWeight: 345.50544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)C[NH+](C)CC3=CSC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=S)N(N2)C[NH+](C)CC3=CSC=C3

InChI

InChI=1S/C17H20N4S2/c1-3-13-4-6-15(7-5-13)16-18-17(22)21(19-16)12-20(2)10-14-8-9-23-11-14/h4-9,11H,3,10,12H2,1-2H3,(H,18,19,22)/p+1