[4-(4-bromophenyl)sulfanyl-3-nitro-phenyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(4-bromophenyl)sulfanyl-3-nitro-phenyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone Openeye Name: [4-(4-bromophenyl)sulfanyl-3-nitro-phenyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone CAS Name: [4-[(4-bromophenyl)thio]-3-nitrophenyl]-[4-(4-fluorophenyl)-1-piperazinyl]methanone IUPAC Name: [4-(4-bromophenyl)sulfanyl-3-nitrophenyl]-[4-(4-fluorophenyl)piperazin-1-yl]methanone Traditional Name: [4-[(4-bromophenyl)thio]-3-nitro-phenyl]-[4-(4-fluorophenyl)piperazino]methanone Formula: C23H19BrFN3O3S MolecularWeight: 516.382663

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)Br)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)F)C(=O)C3=CC(=C(C=C3)SC4=CC=C(C=C4)Br)[N+](=O)[O-]

InChI

InChI=1S/C23H19BrFN3O3S/c24-17-2-8-20(9-3-17)32-22-10-1-16(15-21(22)28(30)31)23(29)27-13-11-26(12-14-27)19-6-4-18(25)5-7-19/h1-10,15H,11-14H2