2-phenyl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-phenyl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide Openeye Name: 2-phenyl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide CAS Name: 2-phenyl-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]-4-quinolinecarboxamide IUPAC Name: 2-phenyl-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)quinoline-4-carboxamide Traditional Name: 2-phenyl-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]cinchoninamide Formula: C21H18N4OS2 MolecularWeight: 406.52382

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4OS2/c1-2-12-27-21-25-24-20(28-21)23-19(26)16-13-18(14-8-4-3-5-9-14)22-17-11-7-6-10-15(16)17/h3-11,13H,2,12H2,1H3,(H,23,24,26)