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

Systemtic Name: N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]heptanamide Openeye Name: N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]heptanamide CAS Name: N-[5-[(3,5-dimethylphenyl)methylthio]-1,3,4-thiadiazol-2-yl]heptanamide IUPAC Name: N-[5-[(3,5-dimethylphenyl)methylsulfanyl]-1,3,4-thiadiazol-2-yl]heptanamide Traditional Name: N-[5-[(3,5-dimethylbenzyl)thio]-1,3,4-thiadiazol-2-yl]enanthamide Formula: C18H25N3OS2 MolecularWeight: 363.5406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3OS2/c1-4-5-6-7-8-16(22)19-17-20-21-18(24-17)23-12-15-10-13(2)9-14(3)11-15/h9-11H,4-8,12H2,1-3H3,(H,19,20,22)