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

Systemtic Name: N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[5-(2-methoxyethylthio)-1,3,4-thiadiazol-2-yl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[5-(2-methoxyethylsulfanyl)-1,3,4-thiadiazol-2-yl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[5-(2-methoxyethylthio)-1,3,4-thiadiazol-2-yl]-2-phenyl-cinchoninamide Formula: C21H18N4O2S2 MolecularWeight: 422.52322

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Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

COCCSC1=NN=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C21H18N4O2S2/c1-27-11-12-28-21-25-24-20(29-21)23-19(26)16-13-18(14-7-3-2-4-8-14)22-17-10-6-5-9-15(16)17/h2-10,13H,11-12H2,1H3,(H,23,24,26)