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

Systemtic Name: N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-2-(4-nitrophenyl)ethanamide Openeye Name: N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-2-(4-nitrophenyl)acetamide CAS Name: N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-2-(4-nitrophenyl)acetamide IUPAC Name: N-[5-[(4-methylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-2-(4-nitrophenyl)acetamide Traditional Name: N-[5-(4-mesylbenzyl)-1,3,4-oxadiazol-2-yl]-2-(4-nitrophenyl)acetamide Formula: C18H16N4O6S MolecularWeight: 416.40784

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)CC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O6S/c1-29(26,27)15-8-4-13(5-9-15)11-17-20-21-18(28-17)19-16(23)10-12-2-6-14(7-3-12)22(24)25/h2-9H,10-11H2,1H3,(H,19,21,23)