(5-chloranyl-2-nitro-phenyl)-[4-(6-fluoranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone

Systemtic Name: (5-chloranyl-2-nitro-phenyl)-[4-(6-fluoranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Openeye Name: (5-chloro-2-nitro-phenyl)-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone CAS Name: (5-chloro-2-nitrophenyl)-[4-(6-fluoro-1,3-benzothiazol-2-yl)-1-piperazinyl]methanone IUPAC Name: (5-chloro-2-nitrophenyl)-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazin-1-yl]methanone Traditional Name: (5-chloro-2-nitro-phenyl)-[4-(6-fluoro-1,3-benzothiazol-2-yl)piperazino]methanone Formula: C18H14ClFN4O3S MolecularWeight: 420.845163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)F)C(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)F)C(=O)C4=C(C=CC(=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H14ClFN4O3S/c19-11-1-4-15(24(26)27)13(9-11)17(25)22-5-7-23(8-6-22)18-21-14-3-2-12(20)10-16(14)28-18/h1-4,9-10H,5-8H2