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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=NN=C(S1)SCC(=O)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CCCCC(=O)NC1=NN=C(S1)SCC(=O)C2=C(C=C(C=C2)C)C

InChI

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