4-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-3-one

Systemtic Name: 4-[2-oxidanylidene-2-[4-(phenylmethyl)piperidin-1-yl]ethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-3-one Openeye Name: 4-[2-(4-benzyl-1-piperidyl)-2-oxo-ethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-3-one CAS Name: 4-[2-oxo-2-[4-(phenylmethyl)-1-piperidinyl]ethyl]-6-(1-pyrrolidinylsulfonyl)-1,4-benzothiazin-3-one IUPAC Name: 4-[2-(4-benzylpiperidin-1-yl)-2-oxoethyl]-6-pyrrolidin-1-ylsulfonyl-1,4-benzothiazin-3-one Traditional Name: 4-[2-(4-benzylpiperidino)-2-keto-ethyl]-6-pyrrolidinosulfonyl-1,4-benzothiazin-3-one Formula: C26H31N3O4S2 MolecularWeight: 513.67204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3CC(=O)N4CCC(CC4)CC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCC(=O)N3CC(=O)N4CCC(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C26H31N3O4S2/c30-25(27-14-10-21(11-15-27)16-20-6-2-1-3-7-20)18-29-23-17-22(8-9-24(23)34-19-26(29)31)35(32,33)28-12-4-5-13-28/h1-3,6-9,17,21H,4-5,10-16,18-19H2