(E)-3-naphthalen-1-yl-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-naphthalen-1-yl-N-[[(4-phenylphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(1-naphthyl)-N-[[(4-phenylbenzoyl)amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(1-naphthalenyl)-N-[[[oxo-(4-phenylphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-naphthalen-1-yl-N-[[(4-phenylbenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(1-naphthyl)-N-[[(4-phenylbenzoyl)amino]thiocarbamoyl]acrylamide Formula: C27H21N3O2S MolecularWeight: 451.53954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C=CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)/C=C/C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C27H21N3O2S/c31-25(18-17-22-11-6-10-21-9-4-5-12-24(21)22)28-27(33)30-29-26(32)23-15-13-20(14-16-23)19-7-2-1-3-8-19/h1-18H,(H,29,32)(H2,28,30,31,33)/b18-17+