1-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]-4-(5-methylthiophen-2-yl)sulfonyl-piperazine

Systemtic Name: 1-[5-chloranyl-2-nitro-4-(trifluoromethyl)phenyl]-4-(5-methylthiophen-2-yl)sulfonyl-piperazine Openeye Name: 1-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-4-[(5-methyl-2-thienyl)sulfonyl]piperazine CAS Name: 1-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-4-[(5-methyl-2-thiophenyl)sulfonyl]piperazine IUPAC Name: 1-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-4-(5-methylthiophen-2-yl)sulfonylpiperazine Traditional Name: 1-[5-chloro-2-nitro-4-(trifluoromethyl)phenyl]-4-[(5-methyl-2-thienyl)sulfonyl]piperazine Formula: C16H15ClF3N3O4S2 MolecularWeight: 469.88621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C(=C3)Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C(=C3)Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClF3N3O4S2/c1-10-2-3-15(28-10)29(26,27)22-6-4-21(5-7-22)13-9-12(17)11(16(18,19)20)8-14(13)23(24)25/h2-3,8-9H,4-7H2,1H3