2-(4-methylsulfonylphenyl)-3-(phenylmethyl)-2H-1,3-benzothiazin-4-one

Systemtic Name: 2-(4-methylsulfonylphenyl)-3-(phenylmethyl)-2H-1,3-benzothiazin-4-one Openeye Name: 3-benzyl-2-(4-methylsulfonylphenyl)-2H-1,3-benzothiazin-4-one CAS Name: 2-(4-methylsulfonylphenyl)-3-(phenylmethyl)-2H-1,3-benzothiazin-4-one IUPAC Name: 3-benzyl-2-(4-methylsulfonylphenyl)-2H-1,3-benzothiazin-4-one Traditional Name: 3-benzyl-2-(4-mesylphenyl)-2H-1,3-benzothiazin-4-one Formula: C22H19NO3S2 MolecularWeight: 409.52116

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C2N(C(=O)C3=CC=CC=C3S2)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C2N(C(=O)C3=CC=CC=C3S2)CC4=CC=CC=C4

InChI

InChI=1S/C22H19NO3S2/c1-28(25,26)18-13-11-17(12-14-18)22-23(15-16-7-3-2-4-8-16)21(24)19-9-5-6-10-20(19)27-22/h2-14,22H,15H2,1H3