bis(2-cyanoethyl)-[[5-(2-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]azanium

Systemtic Name: bis(2-cyanoethyl)-[[5-(2-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]azanium Openeye Name: bis(2-cyanoethyl)-[[5-(2-methoxyphenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]ammonium CAS Name: bis(2-cyanoethyl)-[[5-(2-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]ammonium IUPAC Name: bis(2-cyanoethyl)-[[5-(2-methoxyphenyl)-2-sulfanylidene-1,3,4-oxadiazol-3-yl]methyl]azanium Traditional Name: bis(2-cyanoethyl)-[[5-(2-methoxyphenyl)-2-thioxo-1,3,4-oxadiazol-3-yl]methyl]ammonium Formula: C16H18N5O2S+ MolecularWeight: 344.41142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C(=S)O2)C[NH+](CCC#N)CCC#N

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C(=S)O2)C[NH+](CCC#N)CCC#N

InChI

InChI=1S/C16H17N5O2S/c1-22-14-7-3-2-6-13(14)15-19-21(16(24)23-15)12-20(10-4-8-17)11-5-9-18/h2-3,6-7H,4-5,10-12H2,1H3/p+1