6-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Formula: C20H20N4O6S2 MolecularWeight: 476.526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C20H20N4O6S2/c1-13-2-4-15(24(27)28)11-18(13)32(29,30)23-8-6-22(7-9-23)20(26)14-3-5-17-16(10-14)21-19(25)12-31-17/h2-5,10-11H,6-9,12H2,1H3,(H,21,25)