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

Systemtic Name: 2-methyl-N-[(5-methylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]-3-nitro-benzamide Openeye Name: 2-methyl-N-[(5-methylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]-3-nitro-benzamide CAS Name: 2-methyl-N-[[5-(methylthio)-1,3,4-oxadiazol-2-yl]methyl]-3-nitrobenzamide IUPAC Name: 2-methyl-N-[(5-methylsulfanyl-1,3,4-oxadiazol-2-yl)methyl]-3-nitrobenzamide Traditional Name: 2-methyl-N-[[5-(methylthio)-1,3,4-oxadiazol-2-yl]methyl]-3-nitro-benzamide Formula: C12H12N4O4S MolecularWeight: 308.31308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=C(O2)SC

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)NCC2=NN=C(O2)SC

InChI

InChI=1S/C12H12N4O4S/c1-7-8(4-3-5-9(7)16(18)19)11(17)13-6-10-14-15-12(20-10)21-2/h3-5H,6H2,1-2H3,(H,13,17)