(Z)-3-(3,4-dimethoxyphenyl)-N-[[(2-phenylquinolin-4-yl)carbonylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (Z)-3-(3,4-dimethoxyphenyl)-N-[[(2-phenylquinolin-4-yl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (Z)-3-(3,4-dimethoxyphenyl)-N-[[(2-phenylquinoline-4-carbonyl)amino]carbamothioyl]prop-2-enamide CAS Name: (Z)-3-(3,4-dimethoxyphenyl)-N-[[[oxo-(2-phenyl-4-quinolinyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (Z)-3-(3,4-dimethoxyphenyl)-N-[[(2-phenylquinoline-4-carbonyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (Z)-3-(3,4-dimethoxyphenyl)-N-[[(2-phenylquinoline-4-carbonyl)amino]thiocarbamoyl]acrylamide Formula: C28H24N4O4S MolecularWeight: 512.57956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C\C(=O)NC(=S)NNC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)OC

InChI

InChI=1S/C28H24N4O4S/c1-35-24-14-12-18(16-25(24)36-2)13-15-26(33)30-28(37)32-31-27(34)21-17-23(19-8-4-3-5-9-19)29-22-11-7-6-10-20(21)22/h3-17H,1-2H3,(H,31,34)(H2,30,32,33,37)/b15-13-