methyl 2-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-piperidine-1-carboximidothioate

Systemtic Name: methyl 2-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-piperidine-1-carboximidothioate Openeye Name: methyl 2-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-piperidine-1-carboximidothioate CAS Name: 2-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-1-piperidinecarboximidothioic acid methyl ester IUPAC Name: methyl 2-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-methylpiperidine-1-carboximidothioate Traditional Name: 2-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-piperidine-1-carboximidothioic acid methyl ester Formula: C16H19BrN4OS MolecularWeight: 395.31726

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Descriptors Computed from Structure

Canonical SMILES:

CN=C(N1CCCCC1C2=NC(=NO2)C3=CC(=CC=C3)Br)SC

Isomeric SMILES

CN=C(N1CCCCC1C2=NC(=NO2)C3=CC(=CC=C3)Br)SC

InChI

InChI=1S/C16H19BrN4OS/c1-18-16(23-2)21-9-4-3-8-13(21)15-19-14(20-22-15)11-6-5-7-12(17)10-11/h5-7,10,13H,3-4,8-9H2,1-2H3