3-cyclohexyl-N-[(2-naphthalen-2-yloxyethanoylamino)carbamothioyl]propanamide

Systemtic Name: 3-cyclohexyl-N-[(2-naphthalen-2-yloxyethanoylamino)carbamothioyl]propanamide Openeye Name: 3-cyclohexyl-N-[[[2-(2-naphthyloxy)acetyl]amino]carbamothioyl]propanamide CAS Name: 3-cyclohexyl-N-[[[2-(2-naphthalenyloxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-cyclohexyl-N-[[(2-naphthalen-2-yloxyacetyl)amino]carbamothioyl]propanamide Traditional Name: 3-cyclohexyl-N-[[[2-(2-naphthoxy)acetyl]amino]thiocarbamoyl]propionamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CCC(=O)NC(=S)NNC(=O)COC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1CCC(CC1)CCC(=O)NC(=S)NNC(=O)COC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H27N3O3S/c26-20(13-10-16-6-2-1-3-7-16)23-22(29)25-24-21(27)15-28-19-12-11-17-8-4-5-9-18(17)14-19/h4-5,8-9,11-12,14,16H,1-3,6-7,10,13,15H2,(H,24,27)(H2,23,25,26,29)