4-[[5-(2-ethoxyphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propyl-benzamide

Systemtic Name: 4-[[5-(2-ethoxyphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propyl-benzamide Openeye Name: 4-[[5-(2-ethoxyphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propyl-benzamide CAS Name: 4-[[5-(2-ethoxyphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propylbenzamide IUPAC Name: 4-[[5-(2-ethoxyphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propylbenzamide Traditional Name: 4-[[5-(2-ethoxyphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propyl-benzamide Formula: C21H23N3O5S2 MolecularWeight: 461.55442

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=C(C=C1)CS(=O)(=O)C2=NN=C(S2)OC3=CC=CC=C3OCC

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)CS(=O)(=O)C2=NN=C(S2)OC3=CC=CC=C3OCC

InChI

InChI=1S/C21H23N3O5S2/c1-3-13-22-19(25)16-11-9-15(10-12-16)14-31(26,27)21-24-23-20(30-21)29-18-8-6-5-7-17(18)28-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,22,25)