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

Systemtic Name: N-[5-[2-oxidanylidene-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]ethanamide Openeye Name: N-[5-[2-oxo-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide CAS Name: N-[5-[[2-oxo-2-(4-pentylphenyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]acetamide IUPAC Name: N-[5-[2-oxo-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]acetamide Traditional Name: N-[5-[[2-(4-amylphenyl)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]acetamide Formula: C17H21N3O2S2 MolecularWeight: 363.49754

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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