(E)-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[[(3-oxidanylnaphthalen-2-yl)carbonylamino]carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[[[(3-hydroxy-2-naphthalenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[[(3-hydroxynaphthalene-2-carbonyl)amino]carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[[(3-hydroxy-2-naphthoyl)amino]thiocarbamoyl]-3-phenyl-acrylamide Formula: C21H17N3O3S MolecularWeight: 391.44298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC3=CC=CC=C3C=C2O

InChI

InChI=1S/C21H17N3O3S/c25-18-13-16-9-5-4-8-15(16)12-17(18)20(27)23-24-21(28)22-19(26)11-10-14-6-2-1-3-7-14/h1-13,25H,(H,23,27)(H2,22,24,26,28)/b11-10+