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

Systemtic Name: N-[5-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]hexanamide Openeye Name: N-[5-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]hexanamide CAS Name: N-[5-[[2-(4-methylphenyl)-2-oxoethyl]thio]-1,3,4-thiadiazol-2-yl]hexanamide IUPAC Name: N-[5-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]hexanamide Traditional Name: N-[5-[[2-keto-2-(p-tolyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]hexanamide Formula: C17H21N3O2S2 MolecularWeight: 363.49754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=NN=C(S1)SCC(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCC(=O)NC1=NN=C(S1)SCC(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C17H21N3O2S2/c1-3-4-5-6-15(22)18-16-19-20-17(24-16)23-11-14(21)13-9-7-12(2)8-10-13/h7-10H,3-6,11H2,1-2H3,(H,18,19,22)