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

Systemtic Name: 2-nitro-N-[5-[(4-propan-2-ylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide Openeye Name: N-[5-[(4-isopropylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]-2-nitro-benzamide CAS Name: 2-nitro-N-[5-[(4-propan-2-ylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide IUPAC Name: 2-nitro-N-[5-[(4-propan-2-ylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide Traditional Name: N-[5-(4-isopropylsulfonylbenzyl)-1,3,4-oxadiazol-2-yl]-2-nitro-benzamide Formula: C19H18N4O6S MolecularWeight: 430.43442

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O6S/c1-12(2)30(27,28)14-9-7-13(8-10-14)11-17-21-22-19(29-17)20-18(24)15-5-3-4-6-16(15)23(25)26/h3-10,12H,11H2,1-2H3,(H,20,22,24)