2-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-yl-carbamothioyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-yl-carbamothioyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-isopropyl-carbamothioyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-ylamino]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-ylcarbamothioyl]amino]ethyl-dimethylazanium Traditional Name: 2-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-isopropyl-thiocarbamoyl]amino]ethyl-dimethyl-ammonium Formula: C17H25ClN5OS+ MolecularWeight: 382.9313

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NN=C(O1)C2=CC=C(C=C2)Cl)C(=S)NCC[NH+](C)C

Isomeric SMILES

CC(C)N(CC1=NN=C(O1)C2=CC=C(C=C2)Cl)C(=S)NCC[NH+](C)C

InChI

InChI=1S/C17H24ClN5OS/c1-12(2)23(17(25)19-9-10-22(3)4)11-15-20-21-16(24-15)13-5-7-14(18)8-6-13/h5-8,12H,9-11H2,1-4H3,(H,19,25)/p+1