(E)-3-(4-ethoxyphenyl)-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]prop-2-enamide

Systemtic Name: (E)-3-(4-ethoxyphenyl)-N-[[(4-nitrophenyl)carbonylamino]carbamothioyl]prop-2-enamide Openeye Name: (E)-3-(4-ethoxyphenyl)-N-[[(4-nitrobenzoyl)amino]carbamothioyl]prop-2-enamide CAS Name: (E)-3-(4-ethoxyphenyl)-N-[[[(4-nitrophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: (E)-3-(4-ethoxyphenyl)-N-[[(4-nitrobenzoyl)amino]carbamothioyl]prop-2-enamide Traditional Name: (E)-N-[[(4-nitrobenzoyl)amino]thiocarbamoyl]-3-p-phenetyl-acrylamide Formula: C19H18N4O5S MolecularWeight: 414.43502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=CC(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/C(=O)NC(=S)NNC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O5S/c1-2-28-16-10-3-13(4-11-16)5-12-17(24)20-19(29)22-21-18(25)14-6-8-15(9-7-14)23(26)27/h3-12H,2H2,1H3,(H,21,25)(H2,20,22,24,29)/b12-5+