N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-(phenylmethylsulfanyl)ethanamide

Systemtic Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[5-(2,2-dimethylpropyl)-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: 2-(benzylthio)-N-(5-neopentyl-1,3,4-thiadiazol-2-yl)acetamide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC1=NN=C(S1)NC(=O)CSCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)CC1=NN=C(S1)NC(=O)CSCC2=CC=CC=C2

InChI

InChI=1S/C16H21N3OS2/c1-16(2,3)9-14-18-19-15(22-14)17-13(20)11-21-10-12-7-5-4-6-8-12/h4-8H,9-11H2,1-3H3,(H,17,19,20)