(E)-N-[(2-chloranyl-5-nitro-phenyl)carbamothioyl]-3-(furan-2-yl)prop-2-enamide

Systemtic Name: (E)-N-[(2-chloranyl-5-nitro-phenyl)carbamothioyl]-3-(furan-2-yl)prop-2-enamide Openeye Name: (E)-N-[(2-chloro-5-nitro-phenyl)carbamothioyl]-3-(2-furyl)prop-2-enamide CAS Name: (E)-N-[(2-chloro-5-nitroanilino)-sulfanylidenemethyl]-3-(2-furanyl)-2-propenamide IUPAC Name: (E)-N-[(2-chloro-5-nitrophenyl)carbamothioyl]-3-(furan-2-yl)prop-2-enamide Traditional Name: (E)-N-[(2-chloro-5-nitro-phenyl)thiocarbamoyl]-3-(2-furyl)acrylamide Formula: C14H10ClN3O4S MolecularWeight: 351.7649

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)C=CC(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

C1=COC(=C1)/C=C/C(=O)NC(=S)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C14H10ClN3O4S/c15-11-5-3-9(18(20)21)8-12(11)16-14(23)17-13(19)6-4-10-2-1-7-22-10/h1-8H,(H2,16,17,19,23)/b6-4+