2-bromanyl-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]benzamide Formula: C20H16BrN3O2S MolecularWeight: 442.32894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C20H16BrN3O2S/c21-17-11-4-3-10-16(17)19(26)22-20(27)24-23-18(25)12-14-8-5-7-13-6-1-2-9-15(13)14/h1-11H,12H2,(H,23,25)(H2,22,24,26,27)