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

Systemtic Name: 6-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-[4-(4-ethoxyphenyl)sulfonylpiperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one CAS Name: 6-[[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-[4-(4-ethoxyphenyl)sulfonylpiperazine-1-carbonyl]-4H-1,4-benzothiazin-3-one Traditional Name: 6-(4-p-phenetylsulfonylpiperazine-1-carbonyl)-4H-1,4-benzothiazin-3-one Formula: C21H23N3O5S2 MolecularWeight: 461.55442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)SCC(=O)N4

InChI

InChI=1S/C21H23N3O5S2/c1-2-29-16-4-6-17(7-5-16)31(27,28)24-11-9-23(10-12-24)21(26)15-3-8-19-18(13-15)22-20(25)14-30-19/h3-8,13H,2,9-12,14H2,1H3,(H,22,25)