5-(4-bromophenyl)-N-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]carbothioyl-furan-2-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-[4-(2-chloranyl-6-nitro-phenyl)piperazin-1-yl]carbothioyl-furan-2-carboxamide Openeye Name: 5-(4-bromophenyl)-N-[4-(2-chloro-6-nitro-phenyl)piperazine-1-carbothioyl]furan-2-carboxamide CAS Name: 5-(4-bromophenyl)-N-[[4-(2-chloro-6-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]-2-furancarboxamide IUPAC Name: 5-(4-bromophenyl)-N-[4-(2-chloro-6-nitrophenyl)piperazine-1-carbothioyl]furan-2-carboxamide Traditional Name: 5-(4-bromophenyl)-N-[4-(2-chloro-6-nitro-phenyl)piperazine-1-carbothioyl]-2-furamide Formula: C22H18BrClN4O4S MolecularWeight: 549.82472

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=CC=C2Cl)[N+](=O)[O-])C(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CN(CCN1C2=C(C=CC=C2Cl)[N+](=O)[O-])C(=S)NC(=O)C3=CC=C(O3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H18BrClN4O4S/c23-15-6-4-14(5-7-15)18-8-9-19(32-18)21(29)25-22(33)27-12-10-26(11-13-27)20-16(24)2-1-3-17(20)28(30)31/h1-9H,10-13H2,(H,25,29,33)