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

Systemtic Name: 2-(furan-2-yl)-N-[[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]carbamothioyl]quinoline-4-carboxamide Openeye Name: N-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamothioyl]-2-(2-furyl)quinoline-4-carboxamide CAS Name: 2-(2-furanyl)-N-[[[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]amino]-sulfanylidenemethyl]-4-quinolinecarboxamide IUPAC Name: N-[(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)carbamothioyl]-2-(furan-2-yl)quinoline-4-carboxamide Traditional Name: N-[[5-(benzylthio)-1,3,4-thiadiazol-2-yl]thiocarbamoyl]-2-(2-furyl)cinchoninamide Formula: C24H17N5O2S3 MolecularWeight: 503.61908

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=S)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NN=C(S2)NC(=S)NC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CO5

InChI

InChI=1S/C24H17N5O2S3/c30-21(17-13-19(20-11-6-12-31-20)25-18-10-5-4-9-16(17)18)26-22(32)27-23-28-29-24(34-23)33-14-15-7-2-1-3-8-15/h1-13H,14H2,(H2,26,27,28,30,32)