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

Systemtic Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide CAS Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 4-[(2E)-3,7-dimethylocta-2,6-dienoxy]-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]benzamide Formula: C22H29N3O2S2 MolecularWeight: 431.61456

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)OCC=C(C)CCC=C(C)C

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)OC/C=C(\C)/CCC=C(C)C

InChI

InChI=1S/C22H29N3O2S2/c1-5-15-28-22-25-24-21(29-22)23-20(26)18-9-11-19(12-10-18)27-14-13-17(4)8-6-7-16(2)3/h7,9-13H,5-6,8,14-15H2,1-4H3,(H,23,24,26)/b17-13+