3-bromanyl-4-methyl-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-methyl-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]benzamide Openeye Name: 3-bromo-4-methyl-N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]benzamide CAS Name: 3-bromo-4-methyl-N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-methyl-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]benzamide Traditional Name: 3-bromo-4-methyl-N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]benzamide Formula: C21H18BrN3O2S MolecularWeight: 456.35552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NNC(=O)CC2=CC=CC3=CC=CC=C32)Br

InChI

InChI=1S/C21H18BrN3O2S/c1-13-9-10-16(11-18(13)22)20(27)23-21(28)25-24-19(26)12-15-7-4-6-14-5-2-3-8-17(14)15/h2-11H,12H2,1H3,(H,24,26)(H2,23,25,27,28)