N-[[5-(2-ethoxyethylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[[5-(2-ethoxyethylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[[5-(2-ethoxyethylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]-2-methyl-3-nitro-benzamide CAS Name: N-[[5-(2-ethoxyethylthio)-1,3,4-oxadiazol-2-yl]methyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[[5-(2-ethoxyethylsulfanyl)-1,3,4-oxadiazol-2-yl]methyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[[5-(2-ethoxyethylthio)-1,3,4-oxadiazol-2-yl]methyl]-2-methyl-3-nitro-benzamide Formula: C15H18N4O5S MolecularWeight: 366.39222

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NN=C(O1)CNC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CCOCCSC1=NN=C(O1)CNC(=O)C2=C(C(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H18N4O5S/c1-3-23-7-8-25-15-18-17-13(24-15)9-16-14(20)11-5-4-6-12(10(11)2)19(21)22/h4-6H,3,7-9H2,1-2H3,(H,16,20)