N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]octanamide

Systemtic Name: N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]octanamide Openeye Name: N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]octanamide CAS Name: N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]octanamide IUPAC Name: N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]octanamide Traditional Name: N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]caprylamide Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC(=S)NNC(=O)CC1=CC=CC2=CC=CC=C21

Isomeric SMILES

CCCCCCCC(=O)NC(=S)NNC(=O)CC1=CC=CC2=CC=CC=C21

InChI

InChI=1S/C21H27N3O2S/c1-2-3-4-5-6-14-19(25)22-21(27)24-23-20(26)15-17-12-9-11-16-10-7-8-13-18(16)17/h7-13H,2-6,14-15H2,1H3,(H,23,26)(H2,22,24,25,27)