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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NN=C(S2)SCCC

Isomeric SMILES

CCCOC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NC2=NN=C(S2)SCCC

InChI

InChI=1S/C18H20N4O2S2/c1-3-9-24-15-7-5-13(6-8-15)11-14(12-19)16(23)20-17-21-22-18(26-17)25-10-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,20,21,23)/b14-11+