6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one

Systemtic Name: 6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-(4-tosylpiperazine-1-carbonyl)-4H-1,4-benzothiazin-3-one Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C20H21N3O4S2/c1-14-2-5-16(6-3-14)29(26,27)23-10-8-22(9-11-23)20(25)15-4-7-18-17(12-15)21-19(24)13-28-18/h2-7,12H,8-11,13H2,1H3,(H,21,24)