N-[1-[(3,4-dichlorophenyl)methyl]-1-oxidanidyl-piperidin-1-ium-4-yl]-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[1-[(3,4-dichlorophenyl)methyl]-1-oxidanidyl-piperidin-1-ium-4-yl]-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[1-[(3,4-dichlorophenyl)methyl]-1-oxido-piperidin-1-ium-4-yl]-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide CAS Name: N-[1-[(3,4-dichlorophenyl)methyl]-1-oxido-4-piperidin-1-iumyl]-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]acetamide IUPAC Name: N-[1-[(3,4-dichlorophenyl)methyl]-1-oxidopiperidin-1-ium-4-yl]-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide Traditional Name: N-[1-(3,4-dichlorobenzyl)-1-oxido-piperidin-1-ium-4-yl]-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]acetamide Formula: C21H21Cl2N5O3S MolecularWeight: 494.39414

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](CCC1NC(=O)CSC2=NN=C(O2)C3=CC=NC=C3)(CC4=CC(=C(C=C4)Cl)Cl)[O-]

Isomeric SMILES

C1C[N+](CCC1NC(=O)CSC2=NN=C(O2)C3=CC=NC=C3)(CC4=CC(=C(C=C4)Cl)Cl)[O-]

InChI

InChI=1S/C21H21Cl2N5O3S/c22-17-2-1-14(11-18(17)23)12-28(30)9-5-16(6-10-28)25-19(29)13-32-21-27-26-20(31-21)15-3-7-24-8-4-15/h1-4,7-8,11,16H,5-6,9-10,12-13H2,(H,25,29)