2-ethoxy-N-[5-[(3-methylphenyl)methylsulfonyl]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 2-ethoxy-N-[5-[(3-methylphenyl)methylsulfonyl]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 2-ethoxy-N-[5-(m-tolylmethylsulfonyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 2-ethoxy-N-[5-[(3-methylphenyl)methylsulfonyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 2-ethoxy-N-[5-[(3-methylphenyl)methylsulfonyl]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 2-ethoxy-N-[5-(3-methylbenzyl)sulfonyl-1,3,4-thiadiazol-2-yl]benzamide Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)NC2=NN=C(S2)S(=O)(=O)CC3=CC=CC(=C3)C

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)NC2=NN=C(S2)S(=O)(=O)CC3=CC=CC(=C3)C

InChI

InChI=1S/C19H19N3O4S2/c1-3-26-16-10-5-4-9-15(16)17(23)20-18-21-22-19(27-18)28(24,25)12-14-8-6-7-13(2)11-14/h4-11H,3,12H2,1-2H3,(H,20,21,23)