2-methyl-N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]pentanamide

Systemtic Name: 2-methyl-N-[5-[(phenylmethylsulfanyl)methyl]-1,3,4-thiadiazol-2-yl]pentanamide Openeye Name: N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-2-methyl-pentanamide CAS Name: 2-methyl-N-[5-[(phenylmethylthio)methyl]-1,3,4-thiadiazol-2-yl]pentanamide IUPAC Name: N-[5-(benzylsulfanylmethyl)-1,3,4-thiadiazol-2-yl]-2-methylpentanamide Traditional Name: N-[5-[(benzylthio)methyl]-1,3,4-thiadiazol-2-yl]-2-methyl-valeramide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(=O)NC1=NN=C(S1)CSCC2=CC=CC=C2

Isomeric SMILES

CCCC(C)C(=O)NC1=NN=C(S1)CSCC2=CC=CC=C2

InChI

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