3-ethoxy-1-ethyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide

Systemtic Name: 3-ethoxy-1-ethyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Openeye Name: 3-ethoxy-1-ethyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide CAS Name: 3-ethoxy-1-ethyl-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]-4-pyrazolecarboxamide IUPAC Name: 3-ethoxy-1-ethyl-N-(5-phenacylsulfanyl-1,3,4-thiadiazol-2-yl)pyrazole-4-carboxamide Traditional Name: 3-ethoxy-1-ethyl-N-[5-(phenacylthio)-1,3,4-thiadiazol-2-yl]pyrazole-4-carboxamide Formula: C18H19N5O3S2 MolecularWeight: 417.50516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)OCC)C(=O)NC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

Isomeric SMILES

CCN1C=C(C(=N1)OCC)C(=O)NC2=NN=C(S2)SCC(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19N5O3S2/c1-3-23-10-13(16(22-23)26-4-2)15(25)19-17-20-21-18(28-17)27-11-14(24)12-8-6-5-7-9-12/h5-10H,3-4,11H2,1-2H3,(H,19,20,25)