(4-cyanophenyl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium

Systemtic Name: (4-cyanophenyl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Openeye Name: (4-cyanophenyl)methyl-propyl-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium CAS Name: (4-cyanophenyl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]ammonium IUPAC Name: (4-cyanophenyl)methyl-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Traditional Name: (4-cyanobenzyl)-propyl-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium Formula: C18H19N4OS+ MolecularWeight: 339.43466

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC=C(C=C1)C#N)CC2=NN=C(O2)C3=CC=CS3

Isomeric SMILES

CCC[NH+](CC1=CC=C(C=C1)C#N)CC2=NN=C(O2)C3=CC=CS3

InChI

InChI=1S/C18H18N4OS/c1-2-9-22(12-15-7-5-14(11-19)6-8-15)13-17-20-21-18(23-17)16-4-3-10-24-16/h3-8,10H,2,9,12-13H2,1H3/p+1