2-(4-methylphenyl)sulfonyl-N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]ethanamide

Systemtic Name: 2-(4-methylphenyl)sulfonyl-N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]-2-(p-tolylsulfonyl)acetamide CAS Name: 2-(4-methylphenyl)sulfonyl-N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: 2-(4-methylphenyl)sulfonyl-N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-[5-(3-phenoxypropyl)-1,3,4-thiadiazol-2-yl]-2-tosyl-acetamide Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=NN=C(S2)CCCOC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC(=O)NC2=NN=C(S2)CCCOC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O4S2/c1-15-9-11-17(12-10-15)29(25,26)14-18(24)21-20-23-22-19(28-20)8-5-13-27-16-6-3-2-4-7-16/h2-4,6-7,9-12H,5,8,13-14H2,1H3,(H,21,23,24)