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

Systemtic Name: [3-[(4-methoxyphenoxy)methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [3-[(4-methoxyphenoxy)methyl]-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [3-[(4-methoxyphenoxy)methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [3-[(4-methoxyphenoxy)methyl]-4-methyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [3-[(4-methoxyphenoxy)methyl]-4-methyl-5-thioxo-1,2,4-triazol-1-yl]methyl-methyl-(3-thenyl)ammonium Formula: C18H23N4O2S2+ MolecularWeight: 391.53082

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN(C1=S)C[NH+](C)CC2=CSC=C2)COC3=CC=C(C=C3)OC

Isomeric SMILES

CN1C(=NN(C1=S)C[NH+](C)CC2=CSC=C2)COC3=CC=C(C=C3)OC

InChI

InChI=1S/C18H22N4O2S2/c1-20(10-14-8-9-26-12-14)13-22-18(25)21(2)17(19-22)11-24-16-6-4-15(23-3)5-7-16/h4-9,12H,10-11,13H2,1-3H3/p+1