2-(4-chloranylphenoxy)-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]acetamide Formula: C21H18ClN3O3S MolecularWeight: 427.90392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)COC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H18ClN3O3S/c22-16-8-10-17(11-9-16)28-13-20(27)23-21(29)25-24-19(26)12-15-6-3-5-14-4-1-2-7-18(14)15/h1-11H,12-13H2,(H,24,26)(H2,23,25,27,29)