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

Systemtic Name: (E)-N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(4-ethoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(4-ethoxyphenyl)prop-2-enamide CAS Name: (E)-N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-cyano-3-(4-ethoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(4-ethoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-cyano-3-p-phenetyl-acrylamide Formula: C18H20N4O2S2 MolecularWeight: 388.507

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NN=C(S1)NC(=O)C(=CC2=CC=C(C=C2)OCC)C#N

Isomeric SMILES

CCCCSC1=NN=C(S1)NC(=O)/C(=C/C2=CC=C(C=C2)OCC)/C#N

InChI

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