2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-8-nitro-6-(trifluoromethyl)-1,3-benzothiazin-4-one

Systemtic Name: 2-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-8-nitro-6-(trifluoromethyl)-1,3-benzothiazin-4-one Openeye Name: 2-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-8-nitro-6-(trifluoromethyl)-1,3-benzothiazin-4-one CAS Name: 2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-8-nitro-6-(trifluoromethyl)-1,3-benzothiazin-4-one IUPAC Name: 2-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]-8-nitro-6-(trifluoromethyl)-1,3-benzothiazin-4-one Traditional Name: 2-[4-(5-chloro-2-methyl-phenyl)piperazino]-8-nitro-6-(trifluoromethyl)-1,3-benzothiazin-4-one Formula: C20H16ClF3N4O3S MolecularWeight: 484.87925

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NC(=O)C4=CC(=CC(=C4S3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=NC(=O)C4=CC(=CC(=C4S3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C20H16ClF3N4O3S/c1-11-2-3-13(21)10-15(11)26-4-6-27(7-5-26)19-25-18(29)14-8-12(20(22,23)24)9-16(28(30)31)17(14)32-19/h2-3,8-10H,4-7H2,1H3