(E)-3-(4-butoxyphenyl)-2-cyano-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]-2-propenamide IUPAC Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-butoxyphenyl)-2-cyano-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]acrylamide Formula: C18H20N4O2S2 MolecularWeight: 388.507

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NN=C(S2)SCC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NN=C(S2)SCC

InChI

InChI=1S/C18H20N4O2S2/c1-3-5-10-24-15-8-6-13(7-9-15)11-14(12-19)16(23)20-17-21-22-18(26-17)25-4-2/h6-9,11H,3-5,10H2,1-2H3,(H,20,21,23)/b14-11+