N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pentanamide

Systemtic Name: N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pentanamide Openeye Name: N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pentanamide CAS Name: N-[5-[(3,5-dimethylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]pentanamide IUPAC Name: N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]pentanamide Traditional Name: N-[5-[(3,5-dimethylbenzyl)thio]-1,3,4-thiadiazol-2-yl]valeramide Formula: C16H21N3OS2 MolecularWeight: 335.48744

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=NN=C(S1)SCC2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCCC(=O)NC1=NN=C(S1)SCC2=CC(=CC(=C2)C)C

InChI

InChI=1S/C16H21N3OS2/c1-4-5-6-14(20)17-15-18-19-16(22-15)21-10-13-8-11(2)7-12(3)9-13/h7-9H,4-6,10H2,1-3H3,(H,17,18,20)