4-morpholin-4-yl-3-nitro-N-[[2,4,6-tris(chloranyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-morpholin-4-yl-3-nitro-N-[[2,4,6-tris(chloranyl)phenyl]carbamothioyl]benzamide Openeye Name: 4-morpholino-3-nitro-N-[(2,4,6-trichlorophenyl)carbamothioyl]benzamide CAS Name: 4-(4-morpholinyl)-3-nitro-N-[sulfanylidene-(2,4,6-trichloroanilino)methyl]benzamide IUPAC Name: 4-morpholin-4-yl-3-nitro-N-[(2,4,6-trichlorophenyl)carbamothioyl]benzamide Traditional Name: 4-morpholino-3-nitro-N-[(2,4,6-trichlorophenyl)thiocarbamoyl]benzamide Formula: C18H15Cl3N4O4S MolecularWeight: 489.7601

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C(=O)NC(=S)NC3=C(C=C(C=C3Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C(=O)NC(=S)NC3=C(C=C(C=C3Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H15Cl3N4O4S/c19-11-8-12(20)16(13(21)9-11)22-18(30)23-17(26)10-1-2-14(15(7-10)25(27)28)24-3-5-29-6-4-24/h1-2,7-9H,3-6H2,(H2,22,23,26,30)