diethyl-[[3-(4-methoxyphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]azanium

Systemtic Name: diethyl-[[3-(4-methoxyphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]azanium Openeye Name: diethyl-[[3-(4-methoxyphenyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium CAS Name: diethyl-[[3-(4-methoxyphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]ammonium IUPAC Name: diethyl-[[3-(4-methoxyphenyl)-4-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl]methyl]azanium Traditional Name: diethyl-[[3-(4-methoxyphenyl)-4-phenyl-5-thioxo-1,2,4-triazol-1-yl]methyl]ammonium Formula: C20H25N4OS+ MolecularWeight: 369.5037

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CN1C(=S)N(C(=N1)C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CN1C(=S)N(C(=N1)C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H24N4OS/c1-4-22(5-2)15-23-20(26)24(17-9-7-6-8-10-17)19(21-23)16-11-13-18(25-3)14-12-16/h6-14H,4-5,15H2,1-3H3/p+1