2,3-bis(chloranyl)-N-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]carbothioyl-benzamide

Systemtic Name: 2,3-bis(chloranyl)-N-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]carbothioyl-benzamide Openeye Name: 2,3-dichloro-N-[4-(2-chloro-6-nitro-phenyl)piperazine-1-carbothioyl]benzamide CAS Name: 2,3-dichloro-N-[[4-(2-chloro-6-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]benzamide IUPAC Name: 2,3-dichloro-N-[4-(2-chloro-6-nitrophenyl)piperazine-1-carbothioyl]benzamide Traditional Name: 2,3-dichloro-N-[4-(2-chloro-6-nitro-phenyl)piperazine-1-carbothioyl]benzamide Formula: C18H15Cl3N4O3S MolecularWeight: 473.7607

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=C2Cl)[N+](=O)[O-])C(=S)NC(=O)C3=C(C(=CC=C3)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=C2Cl)[N+](=O)[O-])C(=S)NC(=O)C3=C(C(=CC=C3)Cl)Cl

InChI

InChI=1S/C18H15Cl3N4O3S/c19-12-4-1-3-11(15(12)21)17(26)22-18(29)24-9-7-23(8-10-24)16-13(20)5-2-6-14(16)25(27)28/h1-6H,7-10H2,(H,22,26,29)