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

Systemtic Name: methyl-[(4-methyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[[4-methyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: methyl-[(4-methyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(4-methyl-5-sulfanylidene-3-thiophen-2-yl-1,2,4-triazol-1-yl)methyl]azanium Traditional Name: benzyl-methyl-[[4-methyl-3-(2-thienyl)-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium Formula: C16H19N4S2+ MolecularWeight: 331.47886

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+](C)CC2=CC=CC=C2)C3=CC=CS3

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+](C)CC2=CC=CC=C2)C3=CC=CS3

InChI

InChI=1S/C16H18N4S2/c1-18(11-13-7-4-3-5-8-13)12-20-16(21)19(2)15(17-20)14-9-6-10-22-14/h3-10H,11-12H2,1-2H3/p+1