(E)-3-(2-methoxyphenyl)-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(2-methoxyphenyl)-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-methoxyphenyl)-N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-methoxyphenyl)-N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(2-methoxyphenyl)-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-methoxyphenyl)-N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]acrylamide Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC(=O)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

COC1=CC=CC=C1/C=C/C(=O)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C23H21N3O3S/c1-29-20-12-5-3-8-17(20)13-14-21(27)24-23(30)26-25-22(28)15-18-10-6-9-16-7-2-4-11-19(16)18/h2-14H,15H2,1H3,(H,25,28)(H2,24,26,27,30)/b14-13+