1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone

Systemtic Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Openeye Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone CAS Name: 1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-[6-(1-pyrrolidinylsulfonyl)-2,3-dihydro-1,4-benzothiazin-4-yl]ethanone IUPAC Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(6-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Traditional Name: 1-[4-(2-pyrimidyl)piperazino]-2-(6-pyrrolidinosulfonyl-2,3-dihydro-1,4-benzothiazin-4-yl)ethanone Formula: C22H28N6O3S2 MolecularWeight: 488.62612

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCCN3CC(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC3=C(C=C2)SCCN3CC(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C22H28N6O3S2/c29-21(25-10-12-26(13-11-25)22-23-6-3-7-24-22)17-27-14-15-32-20-5-4-18(16-19(20)27)33(30,31)28-8-1-2-9-28/h3-7,16H,1-2,8-15,17H2