[2-[(4-tert-butylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium

Systemtic Name: [2-[(4-tert-butylphenyl)amino]-2-oxidanylidene-ethyl]-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Openeye Name: [2-(4-tert-butylanilino)-2-oxo-ethyl]-propyl-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium CAS Name: [2-(4-tert-butylanilino)-2-oxoethyl]-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]ammonium IUPAC Name: [2-(4-tert-butylanilino)-2-oxoethyl]-propyl-[(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)methyl]azanium Traditional Name: [2-(4-tert-butylanilino)-2-keto-ethyl]-propyl-[[5-(2-thienyl)-1,3,4-oxadiazol-2-yl]methyl]ammonium Formula: C22H29N4O2S+ MolecularWeight: 413.55626

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=NN=C(O1)C2=CC=CS2)CC(=O)NC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCC[NH+](CC1=NN=C(O1)C2=CC=CS2)CC(=O)NC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H28N4O2S/c1-5-12-26(15-20-24-25-21(28-20)18-7-6-13-29-18)14-19(27)23-17-10-8-16(9-11-17)22(2,3)4/h6-11,13H,5,12,14-15H2,1-4H3,(H,23,27)/p+1