4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C21H27N3O2S2 MolecularWeight: 417.58798

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C21H27N3O2S2/c1-5-27-21-24-23-20(28-21)22-19(25)17-9-11-18(12-10-17)26-14-13-16(4)8-6-7-15(2)3/h7,9-13H,5-6,8,14H2,1-4H3,(H,22,23,25)/b16-13+