N-[3-(2-naphthalen-1-ylethanoylcarbamothioylamino)phenyl]propanamide

Systemtic Name: N-[3-(2-naphthalen-1-ylethanoylcarbamothioylamino)phenyl]propanamide Openeye Name: N-[3-[[2-(1-naphthyl)acetyl]carbamothioylamino]phenyl]propanamide CAS Name: N-[3-[[[[2-(1-naphthalenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: N-[3-[(2-naphthalen-1-ylacetyl)carbamothioylamino]phenyl]propanamide Traditional Name: N-[3-[[2-(1-naphthyl)acetyl]thiocarbamoylamino]phenyl]propionamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32

Isomeric SMILES

CCC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)CC2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C22H21N3O2S/c1-2-20(26)23-17-10-6-11-18(14-17)24-22(28)25-21(27)13-16-9-5-8-15-7-3-4-12-19(15)16/h3-12,14H,2,13H2,1H3,(H,23,26)(H2,24,25,27,28)