N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonyl-benzamide

Systemtic Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonyl-benzamide Openeye Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonyl-benzamide CAS Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonylbenzamide IUPAC Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-propylsulfonylbenzamide Traditional Name: N-(5-neopentyl-1,3,4-thiadiazol-2-yl)-2-propylsulfonyl-benzamide Formula: C17H23N3O3S2 MolecularWeight: 381.51282

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=CC=C1C(=O)NC2=NN=C(S2)CC(C)(C)C

Isomeric SMILES

CCCS(=O)(=O)C1=CC=CC=C1C(=O)NC2=NN=C(S2)CC(C)(C)C

InChI

InChI=1S/C17H23N3O3S2/c1-5-10-25(22,23)13-9-7-6-8-12(13)15(21)18-16-20-19-14(24-16)11-17(2,3)4/h6-9H,5,10-11H2,1-4H3,(H,18,20,21)