(4-bromophenyl)methyl-methyl-[(5-pyridin-4-yl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]azanium

Systemtic Name: (4-bromophenyl)methyl-methyl-[(5-pyridin-4-yl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]azanium Openeye Name: (4-bromophenyl)methyl-methyl-[[5-(4-pyridyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]ammonium CAS Name: (4-bromophenyl)methyl-methyl-[(5-pyridin-4-yl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]ammonium IUPAC Name: (4-bromophenyl)methyl-methyl-[(5-pyridin-4-yl-2-sulfanylidene-1,3,4-oxadiazol-3-yl)methyl]azanium Traditional Name: (4-bromobenzyl)-methyl-[[5-(4-pyridyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]ammonium Formula: C16H16BrN4OS+ MolecularWeight: 392.29344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=C(C=C1)Br)CN2C(=S)OC(=N2)C3=CC=NC=C3

Isomeric SMILES

C[NH+](CC1=CC=C(C=C1)Br)CN2C(=S)OC(=N2)C3=CC=NC=C3

InChI

InChI=1S/C16H15BrN4OS/c1-20(10-12-2-4-14(17)5-3-12)11-21-16(23)22-15(19-21)13-6-8-18-9-7-13/h2-9H,10-11H2,1H3/p+1