(E)-3-(2-chlorophenyl)-N-[(hexanoylamino)carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(2-chlorophenyl)-N-[(hexanoylamino)carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-chlorophenyl)-N-[(hexanoylamino)carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-chlorophenyl)-N-[(1-oxohexylhydrazo)-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(2-chlorophenyl)-N-[(hexanoylamino)carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[(caproylamino)thiocarbamoyl]-3-(2-chlorophenyl)acrylamide Formula: C16H20ClN3O2S MolecularWeight: 353.8669

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NNC(=S)NC(=O)C=CC1=CC=CC=C1Cl

Isomeric SMILES

CCCCCC(=O)NNC(=S)NC(=O)/C=C/C1=CC=CC=C1Cl

InChI

InChI=1S/C16H20ClN3O2S/c1-2-3-4-9-15(22)19-20-16(23)18-14(21)11-10-12-7-5-6-8-13(12)17/h5-8,10-11H,2-4,9H2,1H3,(H,19,22)(H2,18,20,21,23)/b11-10+