N-[[(2-phenylquinolin-4-yl)carbonylamino]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[(2-phenylquinolin-4-yl)carbonylamino]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[(2-phenylquinoline-4-carbonyl)amino]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[[oxo-(2-phenyl-4-quinolinyl)methyl]hydrazo]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[(2-phenylquinoline-4-carbonyl)amino]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[(2-phenylquinoline-4-carbonyl)amino]thiocarbamoyl]thiophene-2-carboxamide 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)NNC(=S)NC(=O)C4=CC=CS4

Isomeric SMILES

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

InChI

InChI=1S/C22H16N4O2S2/c27-20(25-26-22(29)24-21(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,25,27)(H2,24,26,28,29)