2-phenyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide

Systemtic Name: 2-phenyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]quinoline-4-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenyl-quinoline-4-carboxamide CAS Name: 2-phenyl-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-4-quinolinecarboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenylquinoline-4-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-2-phenyl-cinchoninamide Formula: C25H18N4OS2 MolecularWeight: 454.56662

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H18N4OS2/c30-23(27-24-28-29-25(32-24)31-16-17-9-3-1-4-10-17)20-15-22(18-11-5-2-6-12-18)26-21-14-8-7-13-19(20)21/h1-15H,16H2,(H,27,28,30)