3-(4-butoxy-3-ethoxy-phenyl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-(4-butoxy-3-ethoxy-phenyl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-(4-butoxy-3-ethoxy-phenyl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-(4-butoxy-3-ethoxyphenyl)-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(4-butoxy-3-ethoxyphenyl)-N-(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-(4-butoxy-3-ethoxy-phenyl)-N-[5-(methylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C18H25N3O3S2 MolecularWeight: 395.5394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CCC(=O)NC2=NN=C(S2)SC)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CCC(=O)NC2=NN=C(S2)SC)OCC

InChI

InChI=1S/C18H25N3O3S2/c1-4-6-11-24-14-9-7-13(12-15(14)23-5-2)8-10-16(22)19-17-20-21-18(25-3)26-17/h7,9,12H,4-6,8,10-11H2,1-3H3,(H,19,20,22)