[3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl N,N-diethylcarbamodithioate

Systemtic Name: [3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl N,N-diethylcarbamodithioate Openeye Name: [3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [3-(3-nitrophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C14H16N4O3S2 MolecularWeight: 352.43184

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC1=NC(=NO1)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=S)SCC1=NC(=NO1)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H16N4O3S2/c1-3-17(4-2)14(22)23-9-12-15-13(16-21-12)10-6-5-7-11(8-10)18(19)20/h5-8H,3-4,9H2,1-2H3