2,4-bis(chloranyl)-N-[[3-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[[3-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[[3-(2-furylmethylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[3-[(2-furanylmethylamino)-oxomethyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[[3-(furan-2-ylmethylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[[3-(2-furfurylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C20H15Cl2N3O3S MolecularWeight: 448.3224

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)NCC3=CC=CO3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl)C(=O)NCC3=CC=CO3

InChI

InChI=1S/C20H15Cl2N3O3S/c21-13-6-7-16(17(22)10-13)19(27)25-20(29)24-14-4-1-3-12(9-14)18(26)23-11-15-5-2-8-28-15/h1-10H,11H2,(H,23,26)(H2,24,25,27,29)