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

Systemtic Name: (E)-N-[(hexanoylamino)carbamothioyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[(hexanoylamino)carbamothioyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[(1-oxohexylhydrazo)-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[(hexanoylamino)carbamothioyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[(caproylamino)thiocarbamoyl]-3-phenyl-acrylamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NNC(=S)NC(=O)C=CC1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O2S/c1-2-3-5-10-15(21)18-19-16(22)17-14(20)12-11-13-8-6-4-7-9-13/h4,6-9,11-12H,2-3,5,10H2,1H3,(H,18,21)(H2,17,19,20,22)/b12-11+