3-nitro-4-piperidin-1-yl-N-[[2,4,5-tris(chloranyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-nitro-4-piperidin-1-yl-N-[[2,4,5-tris(chloranyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-nitro-4-(1-piperidyl)-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide CAS Name: 3-nitro-4-(1-piperidinyl)-N-[sulfanylidene-(2,4,5-trichloroanilino)methyl]benzamide IUPAC Name: 3-nitro-4-piperidin-1-yl-N-[(2,4,5-trichlorophenyl)carbamothioyl]benzamide Traditional Name: 3-nitro-4-piperidino-N-[(2,4,5-trichlorophenyl)thiocarbamoyl]benzamide Formula: C19H17Cl3N4O3S MolecularWeight: 487.78728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C=C3Cl)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C=C3Cl)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H17Cl3N4O3S/c20-12-9-14(22)15(10-13(12)21)23-19(30)24-18(27)11-4-5-16(17(8-11)26(28)29)25-6-2-1-3-7-25/h4-5,8-10H,1-3,6-7H2,(H2,23,24,27,30)