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

Systemtic Name: 3-methylsulfonyl-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]-3-methylsulfonyl-benzamide CAS Name: 3-methylsulfonyl-N-[5-[(4-propan-2-ylsulfonylphenyl)methyl]-1,3,4-oxadiazol-2-yl]benzamide IUPAC Name: 3-methylsulfonyl-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]-3-mesyl-benzamide Formula: C20H21N3O6S2 MolecularWeight: 463.52724

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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)S(=O)(=O)C

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)CC2=NN=C(O2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C20H21N3O6S2/c1-13(2)31(27,28)16-9-7-14(8-10-16)11-18-22-23-20(29-18)21-19(24)15-5-4-6-17(12-15)30(3,25)26/h4-10,12-13H,11H2,1-3H3,(H,21,23,24)