(E)-N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide

Systemtic Name: (E)-N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide Openeye Name: (E)-N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide CAS Name: (E)-N-[[4-(2-ethoxyethoxy)anilino]-sulfanylidenemethyl]-3-(4-nitrophenyl)-2-propenamide IUPAC Name: (E)-N-[[4-(2-ethoxyethoxy)phenyl]carbamothioyl]-3-(4-nitrophenyl)prop-2-enamide Traditional Name: (E)-N-[[4-(2-ethoxyethoxy)phenyl]thiocarbamoyl]-3-(4-nitrophenyl)acrylamide Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCOC1=CC=C(C=C1)NC(=S)NC(=O)C=CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOCCOC1=CC=C(C=C1)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H21N3O5S/c1-2-27-13-14-28-18-10-6-16(7-11-18)21-20(29)22-19(24)12-5-15-3-8-17(9-4-15)23(25)26/h3-12H,2,13-14H2,1H3,(H2,21,22,24,29)/b12-5+