N-[(2-chloranyl-4-nitro-phenyl)carbamothioyl]-3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enamide

Systemtic Name: N-[(2-chloranyl-4-nitro-phenyl)carbamothioyl]-3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enamide Openeye Name: N-[(2-chloro-4-nitro-phenyl)carbamothioyl]-3-[5-(4-chlorophenyl)-2-furyl]prop-2-enamide CAS Name: N-[(2-chloro-4-nitroanilino)-sulfanylidenemethyl]-3-[5-(4-chlorophenyl)-2-furanyl]-2-propenamide IUPAC Name: N-[(2-chloro-4-nitrophenyl)carbamothioyl]-3-[5-(4-chlorophenyl)furan-2-yl]prop-2-enamide Traditional Name: N-[(2-chloro-4-nitro-phenyl)thiocarbamoyl]-3-[5-(4-chlorophenyl)-2-furyl]acrylamide Formula: C20H13Cl2N3O4S MolecularWeight: 462.30592

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)C=CC(=O)NC(=S)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)C=CC(=O)NC(=S)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C20H13Cl2N3O4S/c21-13-3-1-12(2-4-13)18-9-6-15(29-18)7-10-19(26)24-20(30)23-17-8-5-14(25(27)28)11-16(17)22/h1-11H,(H2,23,24,26,30)