3-(2-chlorophenyl)-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]propanamide

Systemtic Name: 3-(2-chlorophenyl)-N-[(2-naphthalen-1-ylethanoylamino)carbamothioyl]propanamide Openeye Name: 3-(2-chlorophenyl)-N-[[[2-(1-naphthyl)acetyl]amino]carbamothioyl]propanamide CAS Name: 3-(2-chlorophenyl)-N-[[[2-(1-naphthalenyl)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]propanamide IUPAC Name: 3-(2-chlorophenyl)-N-[[(2-naphthalen-1-ylacetyl)amino]carbamothioyl]propanamide Traditional Name: 3-(2-chlorophenyl)-N-[[[2-(1-naphthyl)acetyl]amino]thiocarbamoyl]propionamide Formula: C22H20ClN3O2S MolecularWeight: 425.9311

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)CCC3=CC=CC=C3Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CC(=O)NNC(=S)NC(=O)CCC3=CC=CC=C3Cl

InChI

InChI=1S/C22H20ClN3O2S/c23-19-11-4-2-7-16(19)12-13-20(27)24-22(29)26-25-21(28)14-17-9-5-8-15-6-1-3-10-18(15)17/h1-11H,12-14H2,(H,25,28)(H2,24,26,27,29)