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

Systemtic Name: 6-azanyl-N-[5-[2-oxidanylidene-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]hexanamide Openeye Name: 6-amino-N-[5-[2-oxo-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]hexanamide CAS Name: 6-amino-N-[5-[[2-oxo-2-(4-pentylphenyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]hexanamide IUPAC Name: 6-amino-N-[5-[2-oxo-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]hexanamide Traditional Name: 6-amino-N-[5-[[2-(4-amylphenyl)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]hexanamide Formula: C21H30N4O2S2 MolecularWeight: 434.6185

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)CCCCCN

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(S2)NC(=O)CCCCCN

InChI

InChI=1S/C21H30N4O2S2/c1-2-3-5-8-16-10-12-17(13-11-16)18(26)15-28-21-25-24-20(29-21)23-19(27)9-6-4-7-14-22/h10-13H,2-9,14-15,22H2,1H3,(H,23,24,27)