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

Systemtic Name: (E)-N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(4-propoxyphenyl)prop-2-enamide Openeye Name: (E)-N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(4-propoxyphenyl)prop-2-enamide CAS Name: (E)-N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-cyano-3-(4-propoxyphenyl)-2-propenamide IUPAC Name: (E)-N-(5-butylsulfanyl-1,3,4-thiadiazol-2-yl)-2-cyano-3-(4-propoxyphenyl)prop-2-enamide Traditional Name: (E)-N-[5-(butylthio)-1,3,4-thiadiazol-2-yl]-2-cyano-3-(4-propoxyphenyl)acrylamide Formula: C19H22N4O2S2 MolecularWeight: 402.53358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N4O2S2/c1-3-5-11-26-19-23-22-18(27-19)21-17(24)15(13-20)12-14-6-8-16(9-7-14)25-10-4-2/h6-9,12H,3-5,10-11H2,1-2H3,(H,21,22,24)/b15-12+