2-phenyl-N-[(thiophen-2-ylcarbonylamino)carbamothioyl]quinoline-4-carboxamide

Systemtic Name: 2-phenyl-N-[(thiophen-2-ylcarbonylamino)carbamothioyl]quinoline-4-carboxamide Openeye Name: 2-phenyl-N-[(thiophene-2-carbonylamino)carbamothioyl]quinoline-4-carboxamide CAS Name: N-[[[oxo(thiophen-2-yl)methyl]hydrazo]-sulfanylidenemethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: 2-phenyl-N-[(thiophene-2-carbonylamino)carbamothioyl]quinoline-4-carboxamide Traditional Name: 2-phenyl-N-[(2-thenoylamino)thiocarbamoyl]cinchoninamide Formula: C22H16N4O2S2 MolecularWeight: 432.51804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NNC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NNC(=O)C4=CC=CS4

InChI

InChI=1S/C22H16N4O2S2/c27-20(24-22(29)26-25-21(28)19-11-6-12-30-19)16-13-18(14-7-2-1-3-8-14)23-17-10-5-4-9-15(16)17/h1-13H,(H,25,28)(H2,24,26,27,29)