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

Systemtic Name: (E)-3-(2-chlorophenyl)-N-[[(2-propoxyphenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(2-chlorophenyl)-N-[[(2-propoxybenzoyl)amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(2-chlorophenyl)-N-[[[oxo-(2-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(2-chlorophenyl)-N-[[(2-propoxybenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-3-(2-chlorophenyl)-N-[[(2-propoxybenzoyl)amino]thiocarbamoyl]acrylamide Formula: C20H20ClN3O3S MolecularWeight: 417.9091

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)C=CC2=CC=CC=C2Cl

Isomeric SMILES

CCCOC1=CC=CC=C1C(=O)NNC(=S)NC(=O)/C=C/C2=CC=CC=C2Cl

InChI

InChI=1S/C20H20ClN3O3S/c1-2-13-27-17-10-6-4-8-15(17)19(26)23-24-20(28)22-18(25)12-11-14-7-3-5-9-16(14)21/h3-12H,2,13H2,1H3,(H,23,26)(H2,22,24,25,28)/b12-11+