(E)-N-[(3-ethoxypropanoylamino)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide

Systemtic Name: (E)-N-[(3-ethoxypropanoylamino)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Openeye Name: (E)-N-[(3-ethoxypropanoylamino)carbamothioyl]-3-(p-tolyl)prop-2-enamide CAS Name: (E)-N-[[(3-ethoxy-1-oxopropyl)hydrazo]-sulfanylidenemethyl]-3-(4-methylphenyl)-2-propenamide IUPAC Name: (E)-N-[(3-ethoxypropanoylamino)carbamothioyl]-3-(4-methylphenyl)prop-2-enamide Traditional Name: (E)-N-[(3-ethoxypropanoylamino)thiocarbamoyl]-3-(p-tolyl)acrylamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21N3O3S/c1-3-22-11-10-15(21)18-19-16(23)17-14(20)9-8-13-6-4-12(2)5-7-13/h4-9H,3,10-11H2,1-2H3,(H,18,21)(H2,17,19,20,23)/b9-8+