3-(4H-1,2-benzothiazin-8-yl)-2-[(1-methylsulfonylpiperidin-4-yl)amino]propanoic acid

Systemtic Name: 3-(4H-1,2-benzothiazin-8-yl)-2-[(1-methylsulfonylpiperidin-4-yl)amino]propanoic acid Openeye Name: 3-(4H-1,2-benzothiazin-8-yl)-2-[(1-methylsulfonyl-4-piperidyl)amino]propanoic acid CAS Name: 3-(4H-1,2-benzothiazin-8-yl)-2-[(1-methylsulfonyl-4-piperidinyl)amino]propanoic acid IUPAC Name: 3-(4H-1,2-benzothiazin-8-yl)-2-[(1-methylsulfonylpiperidin-4-yl)amino]propanoic acid Traditional Name: 3-(4H-1,2-benzothiazin-8-yl)-2-[(1-mesyl-4-piperidyl)amino]propionic acid Formula: C17H23N3O4S2 MolecularWeight: 397.51222

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC(CC2=CC=CC3=C2SN=CC3)C(=O)O

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC(CC2=CC=CC3=C2SN=CC3)C(=O)O

InChI

InChI=1S/C17H23N3O4S2/c1-26(23,24)20-9-6-14(7-10-20)19-15(17(21)22)11-13-4-2-3-12-5-8-18-25-16(12)13/h2-4,8,14-15,19H,5-7,9-11H2,1H3,(H,21,22)