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

Systemtic Name: 6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonyl-4H-1,4-benzothiazin-3-one Openeye Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-4H-1,4-benzothiazin-3-one CAS Name: 6-[oxo-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-4H-1,4-benzothiazin-3-one IUPAC Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-4H-1,4-benzothiazin-3-one Traditional Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-4H-1,4-benzothiazin-3-one Formula: C20H21N3O4S2 MolecularWeight: 431.52844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=C(C=C2)SCC(=O)N3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=C(C=C2)SCC(=O)N3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C20H21N3O4S2/c24-19-13-28-18-7-6-16(12-17(18)21-19)20(25)22-8-10-23(11-9-22)29(26,27)14-15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2,(H,21,24)