2-methoxy-N-[5-[(E)-2-methylhex-4-en-2-yl]-1,3,4-thiadiazol-2-yl]-6-propoxy-benzenecarbothioamide

Systemtic Name: 2-methoxy-N-[5-[(E)-2-methylhex-4-en-2-yl]-1,3,4-thiadiazol-2-yl]-6-propoxy-benzenecarbothioamide Openeye Name: N-[5-[(E)-1,1-dimethylpent-3-enyl]-1,3,4-thiadiazol-2-yl]-2-methoxy-6-propoxy-benzenecarbothioamide CAS Name: 2-methoxy-N-[5-[(E)-2-methylhex-4-en-2-yl]-1,3,4-thiadiazol-2-yl]-6-propoxybenzenecarbothioamide IUPAC Name: 2-methoxy-N-[5-[(E)-2-methylhex-4-en-2-yl]-1,3,4-thiadiazol-2-yl]-6-propoxybenzenecarbothioamide Traditional Name: N-[5-[(E)-1,1-dimethylpent-3-enyl]-1,3,4-thiadiazol-2-yl]-2-methoxy-6-propoxy-thiobenzamide Formula: C20H27N3O2S2 MolecularWeight: 405.57728

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1C(=S)NC2=NN=C(S2)C(C)(C)CC=CC)OC

Isomeric SMILES

CCCOC1=CC=CC(=C1C(=S)NC2=NN=C(S2)C(C)(C)C/C=C/C)OC

InChI

InChI=1S/C20H27N3O2S2/c1-6-8-12-20(3,4)18-22-23-19(27-18)21-17(26)16-14(24-5)10-9-11-15(16)25-13-7-2/h6,8-11H,7,12-13H2,1-5H3,(H,21,23,26)/b8-6+