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

Systemtic Name: 3-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-yl-carbamothioyl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-isopropyl-carbamothioyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-ylamino]-sulfanylidenemethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-propan-2-ylcarbamothioyl]amino]propyl-dimethylazanium Traditional Name: 3-[[[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl-isopropyl-thiocarbamoyl]amino]propyl-dimethyl-ammonium Formula: C18H27ClN5OS+ MolecularWeight: 396.95788

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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)NCCC[NH+](C)C

Isomeric SMILES

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

InChI

InChI=1S/C18H26ClN5OS/c1-13(2)24(18(26)20-10-5-11-23(3)4)12-16-21-22-17(25-16)14-6-8-15(19)9-7-14/h6-9,13H,5,10-12H2,1-4H3,(H,20,26)/p+1