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

Systemtic Name: 4-[[5-(2-methylphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propyl-benzamide Openeye Name: 4-[[5-(2-methylphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propyl-benzamide CAS Name: 4-[[5-(2-methylphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propylbenzamide IUPAC Name: 4-[[5-(2-methylphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propylbenzamide Traditional Name: 4-[[5-(2-methylphenoxy)-1,3,4-thiadiazol-2-yl]sulfonylmethyl]-N-propyl-benzamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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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=C3C

Isomeric SMILES

CCCNC(=O)C1=CC=C(C=C1)CS(=O)(=O)C2=NN=C(S2)OC3=CC=CC=C3C

InChI

InChI=1S/C20H21N3O4S2/c1-3-12-21-18(24)16-10-8-15(9-11-16)13-29(25,26)20-23-22-19(28-20)27-17-7-5-4-6-14(17)2/h4-11H,3,12-13H2,1-2H3,(H,21,24)