(E)-N-(2-ethyl-3-oxidanylidene-piperazin-1-yl)carbothioyl-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-(2-ethyl-3-oxidanylidene-piperazin-1-yl)carbothioyl-3-phenyl-prop-2-enamide Openeye Name: (E)-N-(2-ethyl-3-oxo-piperazine-1-carbothioyl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-[(2-ethyl-3-oxo-1-piperazinyl)-sulfanylidenemethyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-(2-ethyl-3-oxopiperazine-1-carbothioyl)-3-phenylprop-2-enamide Traditional Name: (E)-N-(2-ethyl-3-keto-piperazine-1-carbothioyl)-3-phenyl-acrylamide Formula: C16H19N3O2S MolecularWeight: 317.40596

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)NCCN1C(=S)NC(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CCC1C(=O)NCCN1C(=S)NC(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C16H19N3O2S/c1-2-13-15(21)17-10-11-19(13)16(22)18-14(20)9-8-12-6-4-3-5-7-12/h3-9,13H,2,10-11H2,1H3,(H,17,21)(H,18,20,22)/b9-8+