N-[5-(2,3-dimethylpentan-2-yl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxy-benzenecarbothioamide

Systemtic Name: N-[5-(2,3-dimethylpentan-2-yl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxy-benzenecarbothioamide Openeye Name: 2,6-dimethoxy-N-[5-(1,1,2-trimethylbutyl)-1,3,4-thiadiazol-2-yl]benzenecarbothioamide CAS Name: N-[5-(2,3-dimethylpentan-2-yl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxybenzenecarbothioamide IUPAC Name: N-[5-(2,3-dimethylpentan-2-yl)-1,3,4-thiadiazol-2-yl]-2,6-dimethoxybenzenecarbothioamide Traditional Name: 2,6-dimethoxy-N-[5-(1,1,2-trimethylbutyl)-1,3,4-thiadiazol-2-yl]thiobenzamide Formula: C18H25N3O2S2 MolecularWeight: 379.54

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)(C)C1=NN=C(S1)NC(=S)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CCC(C)C(C)(C)C1=NN=C(S1)NC(=S)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C18H25N3O2S2/c1-7-11(2)18(3,4)16-20-21-17(25-16)19-15(24)14-12(22-5)9-8-10-13(14)23-6/h8-11H,7H2,1-6H3,(H,19,21,24)