N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]hexanamide

Systemtic Name: N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]hexanamide Openeye Name: N-[5-(o-tolylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]hexanamide CAS Name: N-[5-[(2-methylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]hexanamide IUPAC Name: N-[5-[(2-methylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]hexanamide Traditional Name: N-[5-[(2-methylbenzyl)thio]-1,3,4-thiadiazol-2-yl]hexanamide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=NN=C(S1)SCC2=CC=CC=C2C

Isomeric SMILES

CCCCCC(=O)NC1=NN=C(S1)SCC2=CC=CC=C2C

InChI

InChI=1S/C16H21N3OS2/c1-3-4-5-10-14(20)17-15-18-19-16(22-15)21-11-13-9-7-6-8-12(13)2/h6-9H,3-5,10-11H2,1-2H3,(H,17,18,20)