3-[5-(4-chlorophenyl)furan-2-yl]-N-[[(4-nitrophenyl)amino]carbamothioyl]prop-2-enamide

Systemtic Name: 3-[5-(4-chlorophenyl)furan-2-yl]-N-[[(4-nitrophenyl)amino]carbamothioyl]prop-2-enamide Openeye Name: 3-[5-(4-chlorophenyl)-2-furyl]-N-[(4-nitroanilino)carbamothioyl]prop-2-enamide CAS Name: 3-[5-(4-chlorophenyl)-2-furanyl]-N-[[(4-nitrophenyl)hydrazo]-sulfanylidenemethyl]-2-propenamide IUPAC Name: 3-[5-(4-chlorophenyl)furan-2-yl]-N-[(4-nitroanilino)carbamothioyl]prop-2-enamide Traditional Name: 3-[5-(4-chlorophenyl)-2-furyl]-N-[(4-nitroanilino)thiocarbamoyl]acrylamide Formula: C20H15ClN4O4S MolecularWeight: 442.8755

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)C=CC(=O)NC(=S)NNC3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)C=CC(=O)NC(=S)NNC3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H15ClN4O4S/c21-14-3-1-13(2-4-14)18-11-9-17(29-18)10-12-19(26)22-20(30)24-23-15-5-7-16(8-6-15)25(27)28/h1-12,23H,(H2,22,24,26,30)