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

Systemtic Name: N-[5-[2-oxidanylidene-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide Openeye Name: N-[5-[2-oxo-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide CAS Name: N-[5-[[2-oxo-2-(4-pentylphenyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: N-[5-[2-oxo-2-(4-pentylphenyl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]propanamide Traditional Name: N-[5-[[2-(4-amylphenyl)-2-keto-ethyl]thio]-1,3,4-thiadiazol-2-yl]propionamide Formula: C18H23N3O2S2 MolecularWeight: 377.52412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O2S2/c1-3-5-6-7-13-8-10-14(11-9-13)15(22)12-24-18-21-20-17(25-18)19-16(23)4-2/h8-11H,3-7,12H2,1-2H3,(H,19,20,23)